N-[1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[1-[2-(4-methoxyphenyl)ethyl]-5-oxo-pyrrolidin-3-yl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[1-[2-(4-methoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[1-[2-(4-methoxyphenyl)ethyl]-5-oxopyrrolidin-3-yl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[5-keto-1-[2-(4-methoxyphenyl)ethyl]pyrrolidin-3-yl]-2-(methylthio)nicotinamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2CC(CC2=O)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)CCN2CC(CC2=O)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C20H23N3O3S/c1-26-16-7-5-14(6-8-16)9-11-23-13-15(12-18(23)24)22-19(25)17-4-3-10-21-20(17)27-2/h3-8,10,15H,9,11-13H2,1-2H3,(H,22,25)