3-(diethoxyphosphinothioylsulfanylmethyl)-4-phenylazanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(diethoxyphosphinothioylsulfanylmethyl)-4-phenylazanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-anilino-3-(diethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazol-5-one CAS Name: 4-anilino-3-[(diethoxyphosphinothioylthio)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-anilino-3-(diethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-anilino-3-[(diethoxythiophosphorylthio)methyl]-1H-1,2,4-triazol-5-one Formula: C13H19N4O3PS2 MolecularWeight: 374.418721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N4O3PS2/c1-3-19-21(22,20-4-2)23-10-12-14-15-13(18)17(12)16-11-8-6-5-7-9-11/h5-9,16H,3-4,10H2,1-2H3,(H,15,18)