N,N'-bis(4-azanyl-2-methyl-quinolin-6-yl)-2-(phenylmethyl)-2-prop-2-enyl-propanediamide hydrochloride

Systemtic Name: N,N'-bis(4-azanyl-2-methyl-quinolin-6-yl)-2-(phenylmethyl)-2-prop-2-enyl-propanediamide hydrochloride Openeye Name: 2-allyl-N,N'-bis(4-amino-2-methyl-6-quinolyl)-2-benzyl-propanediamide hydrochloride CAS Name: N,N'-bis(4-amino-2-methyl-6-quinolinyl)-2-(phenylmethyl)-2-prop-2-enylpropanediamide hydrochloride IUPAC Name: N,N'-bis(4-amino-2-methylquinolin-6-yl)-2-benzyl-2-prop-2-enylpropanediamide hydrochloride Traditional Name: 2-allyl-N,N'-bis(4-amino-2-methyl-6-quinolyl)-2-benzyl-malonamide hydrochloride Formula: C33H33ClN6O2 MolecularWeight: 581.10712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C(CC=C)(CC3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)N=C(C=C5N)C)C(=C1)N.Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C(CC=C)(CC3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)N=C(C=C5N)C)C(=C1)N.Cl

InChI

InChI=1S/C33H32N6O2.ClH/c1-4-14-33(19-22-8-6-5-7-9-22,31(40)38-23-10-12-29-25(17-23)27(34)15-20(2)36-29)32(41)39-24-11-13-30-26(18-24)28(35)16-21(3)37-30;/h4-13,15-18H,1,14,19H2,2-3H3,(H2,34,36)(H2,35,37)(H,38,40)(H,39,41);1H