N-(2-cyanoethyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]acetamide CAS Name: N-(2-cyanoethyl)-2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]acetamide Formula: C19H23N5O3S MolecularWeight: 401.48262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC(=O)NCCC#N

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC(=O)NCCC#N

InChI

InChI=1S/C19H23N5O3S/c1-15-12-16-4-2-5-17(19(16)22-13-15)28(26,27)24-10-8-23(9-11-24)14-18(25)21-7-3-6-20/h2,4-5,12-13H,3,7-11,14H2,1H3,(H,21,25)