3-(diethoxyphosphinothioylsulfanylmethyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(diethoxyphosphinothioylsulfanylmethyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(diethoxyphosphinothioylsulfanylmethyl)-1,2,3-benzotriazin-4-one CAS Name: 3-[(diethoxyphosphinothioylthio)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-(diethoxyphosphinothioylsulfanylmethyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-[(diethoxythiophosphorylthio)methyl]-1,2,3-benzotriazin-4-one Formula: C24H32N6O6P2S4 MolecularWeight: 690.755002

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1.CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1.CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/2C12H16N3O3PS2/c2*1-3-17-19(20,18-4-2)21-9-15-12(16)10-7-5-6-8-11(10)13-14-15/h2*5-8H,3-4,9H2,1-2H3