N-(2-methylsulfanylphenyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(2-methylsulfanylphenyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-(2-methylsulfanylphenyl)-4-pyrazol-1-yl-benzamide CAS Name: N-[2-(methylthio)phenyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-(2-methylsulfanylphenyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-[2-(methylthio)phenyl]-4-pyrazol-1-yl-benzamide Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C17H15N3OS/c1-22-16-6-3-2-5-15(16)19-17(21)13-7-9-14(10-8-13)20-12-4-11-18-20/h2-12H,1H3,(H,19,21)