2-[diphenoxyphosphorylmethyl(naphthalen-2-ylsulfanyl)amino]ethanenitrile

Systemtic Name: 2-[diphenoxyphosphorylmethyl(naphthalen-2-ylsulfanyl)amino]ethanenitrile Openeye Name: 2-[diphenoxyphosphorylmethyl(2-naphthylsulfanyl)amino]acetonitrile CAS Name: N-(cyanomethyl)-N-(diphenoxyphosphorylmethyl)-2-naphthalenesulfenamide IUPAC Name: 2-[diphenoxyphosphorylmethyl(naphthalen-2-ylsulfanyl)amino]acetonitrile Traditional Name: 2-[diphenoxyphosphorylmethyl-(2-naphthylthio)amino]acetonitrile Formula: C25H21N2O3PS MolecularWeight: 460.484601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(CN(CC#N)SC2=CC3=CC=CC=C3C=C2)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(CN(CC#N)SC2=CC3=CC=CC=C3C=C2)OC4=CC=CC=C4

InChI

InChI=1S/C25H21N2O3PS/c26-17-18-27(32-25-16-15-21-9-7-8-10-22(21)19-25)20-31(28,29-23-11-3-1-4-12-23)30-24-13-5-2-6-14-24/h1-16,19H,18,20H2