(2-propan-2-yloxyphenyl) N-[[diethoxyphosphinothioyl(phenyl)amino]sulfanylmethyl]carbamate

Systemtic Name: (2-propan-2-yloxyphenyl) N-[[diethoxyphosphinothioyl(phenyl)amino]sulfanylmethyl]carbamate Openeye Name: (2-isopropoxyphenyl) N-[(N-diethoxyphosphinothioylanilino)sulfanylmethyl]carbamate CAS Name: N-[[(N-diethoxyphosphinothioylanilino)thio]methyl]carbamic acid (2-propan-2-yloxyphenyl) ester IUPAC Name: (2-propan-2-yloxyphenyl) N-[(N-diethoxyphosphinothioylanilino)sulfanylmethyl]carbamate Traditional Name: N-[[(N-diethoxythiophosphorylanilino)thio]methyl]carbamic acid (2-isopropoxyphenyl) ester Formula: C21H29N2O5PS2 MolecularWeight: 484.569121

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(N(C1=CC=CC=C1)SCNC(=O)OC2=CC=CC=C2OC(C)C)OCC

Isomeric SMILES

CCOP(=S)(N(C1=CC=CC=C1)SCNC(=O)OC2=CC=CC=C2OC(C)C)OCC

InChI

InChI=1S/C21H29N2O5PS2/c1-5-25-29(30,26-6-2)23(18-12-8-7-9-13-18)31-16-22-21(24)28-20-15-11-10-14-19(20)27-17(3)4/h7-15,17H,5-6,16H2,1-4H3,(H,22,24)