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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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