N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[4-(pyrrolidinomethyl)benzyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=CNC3=S

InChI

InChI=1S/C18H21N3OS/c22-17(16-4-3-9-19-18(16)23)20-12-14-5-7-15(8-6-14)13-21-10-1-2-11-21/h3-9H,1-2,10-13H2,(H,19,23)(H,20,22)