2-azanyl-5-cyano-N-(3-fluorophenyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: 2-azanyl-5-cyano-N-(3-fluorophenyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-amino-6-benzylsulfanyl-5-cyano-N-(3-fluorophenyl)pyridine-3-carboxamide CAS Name: 2-amino-5-cyano-N-(3-fluorophenyl)-6-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-amino-6-benzylsulfanyl-5-cyano-N-(3-fluorophenyl)pyridine-3-carboxamide Traditional Name: 2-amino-6-(benzylthio)-5-cyano-N-(3-fluorophenyl)nicotinamide Formula: C20H15FN4OS MolecularWeight: 378.422703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC(=CC=C3)F)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=C(C=C2C#N)C(=O)NC3=CC(=CC=C3)F)N

InChI

InChI=1S/C20H15FN4OS/c21-15-7-4-8-16(10-15)24-19(26)17-9-14(11-22)20(25-18(17)23)27-12-13-5-2-1-3-6-13/h1-10H,12H2,(H2,23,25)(H,24,26)