1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-(6-pyrrolidin-1-ylpyridin-3-yl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-(6-pyrrolidin-1-ylpyridin-3-yl)pyrrolidine-3-carboxamide Openeye Name: 1-(4-methylsulfanylphenyl)-5-oxo-N-(6-pyrrolidin-1-yl-3-pyridyl)pyrrolidine-3-carboxamide CAS Name: 1-[4-(methylthio)phenyl]-5-oxo-N-[6-(1-pyrrolidinyl)-3-pyridinyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-methylsulfanylphenyl)-5-oxo-N-(6-pyrrolidin-1-ylpyridin-3-yl)pyrrolidine-3-carboxamide Traditional Name: 5-keto-1-[4-(methylthio)phenyl]-N-(6-pyrrolidino-3-pyridyl)pyrrolidine-3-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CN=C(C=C3)N4CCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CN=C(C=C3)N4CCCC4

InChI

InChI=1S/C21H24N4O2S/c1-28-18-7-5-17(6-8-18)25-14-15(12-20(25)26)21(27)23-16-4-9-19(22-13-16)24-10-2-3-11-24/h4-9,13,15H,2-3,10-12,14H2,1H3,(H,23,27)