4-azanyl-N-(6-oxidanylidene-1H-pyrimidin-2-yl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 4-azanyl-N-(6-oxidanylidene-1H-pyrimidin-2-yl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 4-amino-N-(6-oxo-1H-pyrimidin-2-yl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine CAS Name: 4-amino-N-(6-oxo-1H-pyrimidin-2-yl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine IUPAC Name: 4-amino-N-(6-oxo-1H-pyrimidin-2-yl)benzenesulfonamide; 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-4-yl]amine; 4-amino-N-(6-keto-1H-pyrimidin-2-yl)benzenesulfonamide Formula: C22H23ClN8O3S MolecularWeight: 514.98782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CC(=O)N2

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CC(=O)N2

InChI

InChI=1S/C12H13ClN4.C10H10N4O3S/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7;11-7-1-3-8(4-2-7)18(16,17)14-10-12-6-5-9(15)13-10/h3-6H,2H2,1H3,(H4,14,15,16,17);1-6H,11H2,(H2,12,13,14,15)