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

Systemtic Name: [4-[[1-(4-methoxyphenyl)-5-methyl-1,2,3-triazol-4-yl]carbonylamino]phenyl] thiocyanate Openeye Name: [4-[[1-(4-methoxyphenyl)-5-methyl-triazole-4-carbonyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[[1-(4-methoxyphenyl)-5-methyl-4-triazolyl]-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[[1-(4-methoxyphenyl)-5-methyltriazole-4-carbonyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[1-(4-methoxyphenyl)-5-methyl-triazole-4-carbonyl]amino]phenyl] ester Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5O2S/c1-12-17(18(24)20-13-3-9-16(10-4-13)26-11-19)21-22-23(12)14-5-7-15(25-2)8-6-14/h3-10H,1-2H3,(H,20,24)