N-[4-cyano-3-(phenylmethylsulfanyl)-1H-pyrazol-5-yl]benzamide

Systemtic Name: N-[4-cyano-3-(phenylmethylsulfanyl)-1H-pyrazol-5-yl]benzamide Openeye Name: N-(3-benzylsulfanyl-4-cyano-1H-pyrazol-5-yl)benzamide CAS Name: N-[4-cyano-3-(phenylmethylthio)-1H-pyrazol-5-yl]benzamide IUPAC Name: N-(3-benzylsulfanyl-4-cyano-1H-pyrazol-5-yl)benzamide Traditional Name: N-[3-(benzylthio)-4-cyano-1H-pyrazol-5-yl]benzamide Formula: C18H14N4OS MolecularWeight: 334.39496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4OS/c19-11-15-16(20-17(23)14-9-5-2-6-10-14)21-22-18(15)24-12-13-7-3-1-4-8-13/h1-10H,12H2,(H2,20,21,22,23)