N-[4-(4-cyanophenyl)sulfonyl-3-methyl-piperazin-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: N-[4-(4-cyanophenyl)sulfonyl-3-methyl-piperazin-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: N-[4-(4-cyanophenyl)sulfonyl-3-methyl-piperazin-1-yl]-N-(5-quinolyl)acetamide CAS Name: N-[4-(4-cyanophenyl)sulfonyl-3-methyl-1-piperazinyl]-N-(5-quinolinyl)acetamide IUPAC Name: N-[4-(4-cyanophenyl)sulfonyl-3-methylpiperazin-1-yl]-N-quinolin-5-ylacetamide Traditional Name: N-[4-(4-cyanophenyl)sulfonyl-3-methyl-piperazino]-N-(5-quinolyl)acetamide Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C#N)N(C3=CC=CC4=C3C=CC=N4)C(=O)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C#N)N(C3=CC=CC4=C3C=CC=N4)C(=O)C

InChI

InChI=1S/C23H23N5O3S/c1-17-16-26(13-14-27(17)32(30,31)20-10-8-19(15-24)9-11-20)28(18(2)29)23-7-3-6-22-21(23)5-4-12-25-22/h3-12,17H,13-14,16H2,1-2H3