2-[(4-chlorophenyl)sulfanyl-(diphenoxyphosphorylmethyl)amino]ethanenitrile

Systemtic Name: 2-[(4-chlorophenyl)sulfanyl-(diphenoxyphosphorylmethyl)amino]ethanenitrile Openeye Name: 2-[(4-chlorophenyl)sulfanyl-(diphenoxyphosphorylmethyl)amino]acetonitrile CAS Name: 4-chloro-N-(cyanomethyl)-N-(diphenoxyphosphorylmethyl)benzenesulfenamide IUPAC Name: 2-[(4-chlorophenyl)sulfanyl-(diphenoxyphosphorylmethyl)amino]acetonitrile Traditional Name: 2-[[(4-chlorophenyl)thio]-(diphenoxyphosphorylmethyl)amino]acetonitrile Formula: C21H18ClN2O3PS MolecularWeight: 444.870981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(CN(CC#N)SC2=CC=C(C=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(CN(CC#N)SC2=CC=C(C=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C21H18ClN2O3PS/c22-18-11-13-21(14-12-18)29-24(16-15-23)17-28(25,26-19-7-3-1-4-8-19)27-20-9-5-2-6-10-20/h1-14H,16-17H2