N-[4-[5-(cyanomethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide

Systemtic Name: N-[4-[5-(cyanomethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Openeye Name: N-[4-[5-(cyanomethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide CAS Name: N-[4-[5-(cyanomethylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: N-[4-[5-(cyanomethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Traditional Name: N-[4-[5-(cyanomethylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC#N)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC#N)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15N5OS/c1-23-16(21-22-18(23)25-12-11-19)13-7-9-15(10-8-13)20-17(24)14-5-3-2-4-6-14/h2-10H,12H2,1H3,(H,20,24)