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

Systemtic Name: (4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(SC(=C3C)C)N4C=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(SC(=C3C)C)N4C=CC=C4

InChI

InChI=1S/C23H27N3O4S2/c1-4-30-19-7-9-20(10-8-19)32(28,29)26-15-13-24(14-16-26)22(27)21-17(2)18(3)31-23(21)25-11-5-6-12-25/h5-12H,4,13-16H2,1-3H3