[2-(2,4-dimethylphenyl)quinolin-4-yl]-[4-(1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [2-(2,4-dimethylphenyl)quinolin-4-yl]-[4-(1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: [2-(2,4-dimethylphenyl)-4-quinolyl]-[4-(1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]methanone CAS Name: [2-(2,4-dimethylphenyl)-4-quinolinyl]-[4-[(1-methyl-3-pyrrolyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: [2-(2,4-dimethylphenyl)quinolin-4-yl]-[4-(1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2-(2,4-dimethylphenyl)-4-quinolyl]-[4-(1-methylpyrrol-3-yl)sulfonylpiperazino]methanone Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CN(C=C5)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CN(C=C5)C)C

InChI

InChI=1S/C27H28N4O3S/c1-19-8-9-22(20(2)16-19)26-17-24(23-6-4-5-7-25(23)28-26)27(32)30-12-14-31(15-13-30)35(33,34)21-10-11-29(3)18-21/h4-11,16-18H,12-15H2,1-3H3