3-diethoxyphosphinothioylsulfanyl-6-methyl-4-[(E)-(3-nitrophenyl)methylideneamino]-1,2,4-triazin-5-one

Systemtic Name: 3-diethoxyphosphinothioylsulfanyl-6-methyl-4-[(E)-(3-nitrophenyl)methylideneamino]-1,2,4-triazin-5-one Openeye Name: 3-diethoxyphosphinothioylsulfanyl-6-methyl-4-[(E)-(3-nitrophenyl)methyleneamino]-1,2,4-triazin-5-one CAS Name: 3-(diethoxyphosphinothioylthio)-6-methyl-4-[(E)-(3-nitrophenyl)methylideneamino]-1,2,4-triazin-5-one IUPAC Name: 3-diethoxyphosphinothioylsulfanyl-6-methyl-4-[(E)-(3-nitrophenyl)methylideneamino]-1,2,4-triazin-5-one Traditional Name: 3-(diethoxythiophosphorylthio)-6-methyl-4-[(E)-(3-nitrobenzylidene)amino]-1,2,4-triazin-5-one Formula: C15H18N5O5PS2 MolecularWeight: 443.437681

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)SC1=NN=C(C(=O)N1N=CC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOP(=S)(OCC)SC1=NN=C(C(=O)N1/N=C/C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H18N5O5PS2/c1-4-24-26(27,25-5-2)28-15-18-17-11(3)14(21)19(15)16-10-12-7-6-8-13(9-12)20(22)23/h6-10H,4-5H2,1-3H3/b16-10+