6-(4-ethanoylpiperazin-1-yl)sulfonyl-8-methyl-4-[(3-methylphenyl)amino]quinoline-3-carboxamide

Systemtic Name: 6-(4-ethanoylpiperazin-1-yl)sulfonyl-8-methyl-4-[(3-methylphenyl)amino]quinoline-3-carboxamide Openeye Name: 6-(4-acetylpiperazin-1-yl)sulfonyl-8-methyl-4-(3-methylanilino)quinoline-3-carboxamide CAS Name: 6-[(4-acetyl-1-piperazinyl)sulfonyl]-8-methyl-4-(3-methylanilino)-3-quinolinecarboxamide IUPAC Name: 6-(4-acetylpiperazin-1-yl)sulfonyl-8-methyl-4-(3-methylanilino)quinoline-3-carboxamide Traditional Name: 6-(4-acetylpiperazino)sulfonyl-8-methyl-4-(m-toluidino)quinoline-3-carboxamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C=NC3=C(C=C(C=C32)S(=O)(=O)N4CCN(CC4)C(=O)C)C)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C=NC3=C(C=C(C=C32)S(=O)(=O)N4CCN(CC4)C(=O)C)C)C(=O)N

InChI

InChI=1S/C24H27N5O4S/c1-15-5-4-6-18(11-15)27-23-20-13-19(12-16(2)22(20)26-14-21(23)24(25)31)34(32,33)29-9-7-28(8-10-29)17(3)30/h4-6,11-14H,7-10H2,1-3H3,(H2,25,31)(H,26,27)