methyl 2-[[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]amino]benzoate CAS Name: 2-[[[3-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]amino]benzoate Traditional Name: 2-[[3-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzoyl]amino]benzoic acid methyl ester Formula: C19H18N4O3S MolecularWeight: 382.43622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CN1C=NN=C1SCC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C19H18N4O3S/c1-23-12-20-22-19(23)27-11-13-6-5-7-14(10-13)17(24)21-16-9-4-3-8-15(16)18(25)26-2/h3-10,12H,11H2,1-2H3,(H,21,24)