(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2,5-dimethyl-1-phenyl-pyrrol-3-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methanone CAS Name: (2,5-dimethyl-1-phenyl-3-pyrrolyl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(2,5-dimethyl-1-phenylpyrrol-3-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methanone Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-19-17-23(20(2)27(19)22-11-7-4-8-12-22)24(28)25-13-15-26(16-14-25)31(29,30)18-21-9-5-3-6-10-21/h3-12,17H,13-16,18H2,1-2H3