[4-[(5-methyl-1-phenyl-1,2,3-triazol-4-yl)carbonylamino]phenyl] thiocyanate

Systemtic Name: [4-[(5-methyl-1-phenyl-1,2,3-triazol-4-yl)carbonylamino]phenyl] thiocyanate Openeye Name: [4-[(5-methyl-1-phenyl-triazole-4-carbonyl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[(5-methyl-1-phenyl-4-triazolyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(5-methyl-1-phenyltriazole-4-carbonyl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(5-methyl-1-phenyl-triazole-4-carbonyl)amino]phenyl] ester Formula: C17H13N5OS MolecularWeight: 335.38302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)SC#N

Isomeric SMILES

CC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)SC#N

InChI

InChI=1S/C17H13N5OS/c1-12-16(20-21-22(12)14-5-3-2-4-6-14)17(23)19-13-7-9-15(10-8-13)24-11-18/h2-10H,1H3,(H,19,23)