2-methylsulfanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Openeye Name: 2-methylsulfanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide CAS Name: 2-(methylthio)-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Traditional Name: 2-(methylthio)-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C16H14N4OS/c1-22-15-5-3-2-4-14(15)16(21)19-12-6-8-13(9-7-12)20-11-17-10-18-20/h2-11H,1H3,(H,19,21)