ethyl 1-[3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]propanoyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]propanoyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxo-pyrrolidin-2-yl]propanoyl]piperidine-2-carboxylate CAS Name: 1-[3-[2-[[4-(methylthio)phenyl]methyl]-5-oxo-2-pyrrolidinyl]-1-oxopropyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxopyrrolidin-2-yl]propanoyl]piperidine-2-carboxylate Traditional Name: 1-[3-[5-keto-2-[4-(methylthio)benzyl]pyrrolidin-2-yl]propanoyl]pipecolinic acid ethyl ester Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)CCC2(CCC(=O)N2)CC3=CC=C(C=C3)SC

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)CCC2(CCC(=O)N2)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C23H32N2O4S/c1-3-29-22(28)19-6-4-5-15-25(19)21(27)12-14-23(13-11-20(26)24-23)16-17-7-9-18(30-2)10-8-17/h7-10,19H,3-6,11-16H2,1-2H3,(H,24,26)