[2-(2-hydroxyethyl)piperazin-1-yl]-[3-[(4-methoxyphenyl)methylsulfanyl]-1-methyl-pyrrolidin-3-yl]methanone

Systemtic Name: [2-(2-hydroxyethyl)piperazin-1-yl]-[3-[(4-methoxyphenyl)methylsulfanyl]-1-methyl-pyrrolidin-3-yl]methanone Openeye Name: [2-(2-hydroxyethyl)piperazin-1-yl]-[3-[(4-methoxyphenyl)methylsulfanyl]-1-methyl-pyrrolidin-3-yl]methanone CAS Name: [2-(2-hydroxyethyl)-1-piperazinyl]-[3-[(4-methoxyphenyl)methylthio]-1-methyl-3-pyrrolidinyl]methanone IUPAC Name: [2-(2-hydroxyethyl)piperazin-1-yl]-[3-[(4-methoxyphenyl)methylsulfanyl]-1-methylpyrrolidin-3-yl]methanone Traditional Name: [2-(2-hydroxyethyl)piperazino]-[1-methyl-3-(p-anisylthio)pyrrolidin-3-yl]methanone Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1)(C(=O)N2CCNCC2CCO)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCC(C1)(C(=O)N2CCNCC2CCO)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H31N3O3S/c1-22-10-8-20(15-22,27-14-16-3-5-18(26-2)6-4-16)19(25)23-11-9-21-13-17(23)7-12-24/h3-6,17,21,24H,7-15H2,1-2H3