3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]propanamide

Systemtic Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]propanamide Openeye Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[(4-phenyltetrahydropyran-4-yl)methyl]propanamide CAS Name: 3-[2-[[4-(methylthio)phenyl]methyl]-5-oxo-2-pyrrolidinyl]-N-[(4-phenyl-4-oxanyl)methyl]propanamide IUPAC Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxopyrrolidin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]propanamide Traditional Name: 3-[5-keto-2-[4-(methylthio)benzyl]pyrrolidin-2-yl]-N-[(4-phenyltetrahydropyran-4-yl)methyl]propionamide Formula: C27H34N2O3S MolecularWeight: 466.63546

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC2(CCC(=O)N2)CCC(=O)NCC3(CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CC2(CCC(=O)N2)CCC(=O)NCC3(CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N2O3S/c1-33-23-9-7-21(8-10-23)19-27(14-12-25(31)29-27)13-11-24(30)28-20-26(15-17-32-18-16-26)22-5-3-2-4-6-22/h2-10H,11-20H2,1H3,(H,28,30)(H,29,31)