[2-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl] (E)-3-phenylsulfanylprop-2-enoate

Systemtic Name: [2-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl] (E)-3-phenylsulfanylprop-2-enoate Openeye Name: [2-[[2-(3-methoxyanilino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl] (E)-3-phenylsulfanylprop-2-enoate CAS Name: (E)-3-(phenylthio)-2-propenoic acid [2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] (E)-3-phenylsulfanylprop-2-enoate Traditional Name: (E)-3-(phenylthio)acrylic acid [2-keto-2-[[2-keto-2-(m-anisidino)ethyl]-methyl-amino]ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)OC)C(=O)COC(=O)C=CSC2=CC=CC=C2

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)OC)C(=O)COC(=O)/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C21H22N2O5S/c1-23(14-19(24)22-16-7-6-8-17(13-16)27-2)20(25)15-28-21(26)11-12-29-18-9-4-3-5-10-18/h3-13H,14-15H2,1-2H3,(H,22,24)/b12-11+