(E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enamide

Systemtic Name: (E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enamide Openeye Name: (E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-methylsulfanyl-prop-2-enamide CAS Name: (E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenylmethyl]amino]-2-cyano-3-(methylthio)-2-propenamide IUPAC Name: (E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenylmethyl]amino]-2-cyano-3-methylsulfanylprop-2-enamide Traditional Name: (E)-3-[[bis(2-ethoxyethoxy)phosphoryl-phenyl-methyl]amino]-2-cyano-3-(methylthio)acrylamide Formula: C20H30N3O6PS MolecularWeight: 471.507461

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOP(=O)(C(C1=CC=CC=C1)NC(=C(C#N)C(=O)N)SC)OCCOCC

Isomeric SMILES

CCOCCOP(=O)(C(C1=CC=CC=C1)N/C(=C(/C#N)\C(=O)N)/SC)OCCOCC

InChI

InChI=1S/C20H30N3O6PS/c1-4-26-11-13-28-30(25,29-14-12-27-5-2)19(16-9-7-6-8-10-16)23-20(31-3)17(15-21)18(22)24/h6-10,19,23H,4-5,11-14H2,1-3H3,(H2,22,24)/b20-17+