2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carboxamide

Systemtic Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carboxamide Openeye Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carboxamide CAS Name: 2-(cyanomethylthio)-6-cyclopropyl-4-(4-fluorophenyl)-3-pyridinecarboxamide IUPAC Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-fluorophenyl)pyridine-3-carboxamide Traditional Name: 2-(cyanomethylthio)-6-cyclopropyl-4-(4-fluorophenyl)nicotinamide Formula: C17H14FN3OS MolecularWeight: 327.375963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C(=O)N)SCC#N

Isomeric SMILES

C1CC1C2=NC(=C(C(=C2)C3=CC=C(C=C3)F)C(=O)N)SCC#N

InChI

InChI=1S/C17H14FN3OS/c18-12-5-3-10(4-6-12)13-9-14(11-1-2-11)21-17(23-8-7-19)15(13)16(20)22/h3-6,9,11H,1-2,8H2,(H2,20,22)