4-azanyl-N-quinoxalin-2-yl-benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine; methyl 4-acetamido-2-ethoxy-benzoate; 5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propyl-pyrimidin-4-amine; chloride

Systemtic Name: 4-azanyl-N-quinoxalin-2-yl-benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine; methyl 4-acetamido-2-ethoxy-benzoate; 5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propyl-pyrimidin-4-amine; chloride Openeye Name: 4-amino-N-quinoxalin-2-yl-benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine; methyl 4-acetamido-2-ethoxy-benzoate; 5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propyl-pyrimidin-4-amine; chloride CAS Name: 4-acetamido-2-ethoxybenzoic acid methyl ester; 4-amino-N-(2-quinoxalinyl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine; 5-[(2-methyl-1-pyridin-1-iumyl)methyl]-2-propyl-4-pyrimidinamine; chloride IUPAC Name: 4-amino-N-quinoxalin-2-ylbenzenesulfonamide; 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine; methyl 4-acetamido-2-ethoxybenzoate; 5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propylpyrimidin-4-amine; chloride Traditional Name: 4-acetamido-2-ethoxy-benzoic acid methyl ester; [2-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-4-yl]amine; 4-amino-N-quinoxalin-2-yl-benzenesulfonamide; [5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propyl-pyrimidin-4-yl]amine; chloride Formula: C52H59Cl2N13O6S MolecularWeight: 1065.07936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2C.CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.CCOC1=C(C=CC(=C1)NC(=O)C)C(=O)OC.C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N.[Cl-]

Isomeric SMILES

CCCC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2C.CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.CCOC1=C(C=CC(=C1)NC(=O)C)C(=O)OC.C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N.[Cl-]

InChI

InChI=1S/C14H12N4O2S.C14H19N4.C12H13ClN4.C12H15NO4.ClH/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14;1-3-6-13-16-9-12(14(15)17-13)10-18-8-5-4-7-11(18)2;1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7;1-4-17-11-7-9(13-8(2)14)5-6-10(11)12(15)16-3;/h1-9H,15H2,(H,17,18);4-5,7-9H,3,6,10H2,1-2H3,(H2,15,16,17);3-6H,2H2,1H3,(H4,14,15,16,17);5-7H,4H2,1-3H3,(H,13,14);1H/q;+1;;;/p-1