3-(diethoxyphosphinothioylsulfanylmethyl)-4-phenylazanyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(diethoxyphosphinothioylsulfanylmethyl)-4-phenylazanyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-anilino-3-(diethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-anilino-3-[(diethoxyphosphinothioylthio)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-anilino-3-(diethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-anilino-3-[(diethoxythiophosphorylthio)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H19N4O2PS3 MolecularWeight: 390.484321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)SCC1=NNC(=S)N1NC2=CC=CC=C2

Isomeric SMILES

CCOP(=S)(OCC)SCC1=NNC(=S)N1NC2=CC=CC=C2

InChI

InChI=1S/C13H19N4O2PS3/c1-3-18-20(22,19-4-2)23-10-12-14-15-13(21)17(12)16-11-8-6-5-7-9-11/h5-9,16H,3-4,10H2,1-2H3,(H,15,21)