(E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-methylsulfanyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-methylsulfanyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-methylsulfanyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-(methylthio)-2-propenamide IUPAC Name: (E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-methylsulfanylprop-2-enamide Traditional Name: (E)-2-cyano-3-[[diethoxyphosphoryl(phenyl)methyl]amino]-3-(methylthio)acrylamide Formula: C16H22N3O4PS MolecularWeight: 383.402341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC=C1)NC(=C(C#N)C(=O)N)SC)OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=CC=C1)N/C(=C(/C#N)\C(=O)N)/SC)OCC

InChI

InChI=1S/C16H22N3O4PS/c1-4-22-24(21,23-5-2)15(12-9-7-6-8-10-12)19-16(25-3)13(11-17)14(18)20/h6-10,15,19H,4-5H2,1-3H3,(H2,18,20)/b16-13+