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

Systemtic Name: 3-(dimethoxyphosphinothioylsulfanylmethyl)-4-phenylazanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-anilino-3-(dimethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazol-5-one CAS Name: 4-anilino-3-[(dimethoxyphosphinothioylthio)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-anilino-3-(dimethoxyphosphinothioylsulfanylmethyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-anilino-3-[(dimethoxythiophosphorylthio)methyl]-1H-1,2,4-triazol-5-one Formula: C11H15N4O3PS2 MolecularWeight: 346.365561

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Descriptors Computed from Structure

Canonical SMILES:

COP(=S)(OC)SCC1=NNC(=O)N1NC2=CC=CC=C2

Isomeric SMILES

COP(=S)(OC)SCC1=NNC(=O)N1NC2=CC=CC=C2

InChI

InChI=1S/C11H15N4O3PS2/c1-17-19(20,18-2)21-8-10-12-13-11(16)15(10)14-9-6-4-3-5-7-9/h3-7,14H,8H2,1-2H3,(H,13,16)