3,3-diphenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanimidate

Systemtic Name: 3,3-diphenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanimidate Openeye Name: 3,3-diphenyl-N-(5-thioxo-1H-1,2,4-triazol-4-yl)propanimidate CAS Name: 3,3-diphenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanimidate IUPAC Name: 3,3-diphenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanimidate Traditional Name: 3,3-diphenyl-N-(5-thioxo-1H-1,2,4-triazol-4-yl)propionimidate Formula: C17H15N4OS- MolecularWeight: 323.3922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=NN2C=NNC2=S)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=NN2C=NNC2=S)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c22-16(20-21-12-18-19-17(21)23)11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,15H,11H2,(H,19,23)(H,20,22)/p-1