[4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(m-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(2,5-dimethyl-1-pyrrolyl)phenyl]-[4-(3-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(m-tolylsulfonyl)piperazino]methanone Formula: C24H27N3O3S MolecularWeight: 437.55448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=CC=C4C)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=CC=C4C)C

InChI

InChI=1S/C24H27N3O3S/c1-18-5-4-6-23(17-18)31(29,30)26-15-13-25(14-16-26)24(28)21-9-11-22(12-10-21)27-19(2)7-8-20(27)3/h4-12,17H,13-16H2,1-3H3