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

Systemtic Name: [1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-3-pyrrolyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [1-(3,4-dimethoxyphenyl)-2-methyl-5-phenylpyrrol-3-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-pyrrol-3-yl]-(4-tosylpiperazino)methanone Formula: C31H33N3O5S MolecularWeight: 559.67582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)OC)C

InChI

InChI=1S/C31H33N3O5S/c1-22-10-13-26(14-11-22)40(36,37)33-18-16-32(17-19-33)31(35)27-21-28(24-8-6-5-7-9-24)34(23(27)2)25-12-15-29(38-3)30(20-25)39-4/h5-15,20-21H,16-19H2,1-4H3