1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]ethanone Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC(=CN=C54)C

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC(=CN=C54)C

InChI

InChI=1S/C25H30N4O3S/c1-17-13-20-5-4-6-24(25(20)26-15-17)33(31,32)28-11-9-27(10-12-28)16-23(30)22-14-18(2)29(19(22)3)21-7-8-21/h4-6,13-15,21H,7-12,16H2,1-3H3