3-[2-[4-(4-methylphenyl)sulfanylpiperidin-1-yl]-2-oxidanylidene-ethyl]-4-(thiophen-2-ylmethyl)piperazin-2-one

Systemtic Name: 3-[2-[4-(4-methylphenyl)sulfanylpiperidin-1-yl]-2-oxidanylidene-ethyl]-4-(thiophen-2-ylmethyl)piperazin-2-one Openeye Name: 3-[2-oxo-2-[4-(p-tolylsulfanyl)-1-piperidyl]ethyl]-4-(2-thienylmethyl)piperazin-2-one CAS Name: 3-[2-[4-[(4-methylphenyl)thio]-1-piperidinyl]-2-oxoethyl]-4-(thiophen-2-ylmethyl)-2-piperazinone IUPAC Name: 3-[2-[4-(4-methylphenyl)sulfanylpiperidin-1-yl]-2-oxoethyl]-4-(thiophen-2-ylmethyl)piperazin-2-one Traditional Name: 3-[2-keto-2-[4-(p-tolylthio)piperidino]ethyl]-4-(2-thenyl)piperazin-2-one Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)CC3C(=O)NCCN3CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)SC2CCN(CC2)C(=O)CC3C(=O)NCCN3CC4=CC=CS4

InChI

InChI=1S/C23H29N3O2S2/c1-17-4-6-18(7-5-17)30-19-8-11-25(12-9-19)22(27)15-21-23(28)24-10-13-26(21)16-20-3-2-14-29-20/h2-7,14,19,21H,8-13,15-16H2,1H3,(H,24,28)