N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]pyridine-4-carboxamide

Systemtic Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]pyridine-4-carboxamide Openeye Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]pyridine-4-carboxamide CAS Name: N-[3-[(2-chlorophenyl)methylthio]-4-cyano-1H-pyrazol-5-yl]-4-pyridinecarboxamide IUPAC Name: N-[3-[(2-chlorophenyl)methylsulfanyl]-4-cyano-1H-pyrazol-5-yl]pyridine-4-carboxamide Traditional Name: N-[3-[(2-chlorobenzyl)thio]-4-cyano-1H-pyrazol-5-yl]isonicotinamide Formula: C17H12ClN5OS MolecularWeight: 369.82808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)NC(=O)C3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)NC(=O)C3=CC=NC=C3)Cl

InChI

InChI=1S/C17H12ClN5OS/c18-14-4-2-1-3-12(14)10-25-17-13(9-19)15(22-23-17)21-16(24)11-5-7-20-8-6-11/h1-8H,10H2,(H2,21,22,23,24)