propan-2-yl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate

Systemtic Name: propan-2-yl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate Openeye Name: isopropyl 3-[(3-thioxo-2H-1,2,4-triazin-5-yl)amino]benzoate CAS Name: 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(3-sulfanylidene-2H-1,2,4-triazin-5-yl)amino]benzoate Traditional Name: 3-[(3-thioxo-2H-1,2,4-triazin-5-yl)amino]benzoic acid isopropyl ester Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CC=C1)NC2=NC(=S)NN=C2

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CC=C1)NC2=NC(=S)NN=C2

InChI

InChI=1S/C13H14N4O2S/c1-8(2)19-12(18)9-4-3-5-10(6-9)15-11-7-14-17-13(20)16-11/h3-8H,1-2H3,(H2,15,16,17,20)