1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-[5-(1-piperidylsulfonyl)-2-thienyl]ethanone CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]ethanone IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-2-(5-piperidinosulfonyl-2-thienyl)ethanone Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H29N3O4S2/c1-29-20-8-4-3-7-19(20)23-13-15-24(16-14-23)21(26)17-18-9-10-22(30-18)31(27,28)25-11-5-2-6-12-25/h3-4,7-10H,2,5-6,11-17H2,1H3