(3-ethoxy-5-phenyl-thiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-ethoxy-5-phenyl-thiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-ethoxy-5-phenyl-2-thienyl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-ethoxy-5-phenyl-2-thiophenyl)-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-ethoxy-5-phenylthiophen-2-yl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-ethoxy-5-phenyl-2-thienyl)-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC(=C1)C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC1=C(SC(=C1)C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H23N3O4S2/c1-2-29-19-15-20(17-7-4-3-5-8-17)30-21(19)22(26)24-11-13-25(14-12-24)31(27,28)18-9-6-10-23-16-18/h3-10,15-16H,2,11-14H2,1H3