2-methylsulfanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[1-(phenylmethyl)-3-pyrrolidinyl]-3-pyridinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(methylthio)nicotinamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2CCN(C2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2CCN(C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3OS/c1-23-18-16(8-5-10-19-18)17(22)20-15-9-11-21(13-15)12-14-6-3-2-4-7-14/h2-8,10,15H,9,11-13H2,1H3,(H,20,22)