2-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[2-(3-methoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-keto-2-[2-(3-methoxyphenyl)pyrrolidino]ethyl]thio]-N-(p-tolyl)acetamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N2CCCC2C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N2CCCC2C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H26N2O3S/c1-16-8-10-18(11-9-16)23-21(25)14-28-15-22(26)24-12-4-7-20(24)17-5-3-6-19(13-17)27-2/h3,5-6,8-11,13,20H,4,7,12,14-15H2,1-2H3,(H,23,25)