(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)methanone Traditional Name: (4-besylpiperazino)-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C21H23N3O3S2/c1-16-17(2)28-21(23-10-6-7-11-23)19(16)20(25)22-12-14-24(15-13-22)29(26,27)18-8-4-3-5-9-18/h3-11H,12-15H2,1-2H3