methyl 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(ethylsulfanylmethyl)phenyl]carbonyl-amino]-2-methylidene-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(ethylsulfanylmethyl)phenyl]carbonyl-amino]-2-methylidene-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(ethylsulfanylmethyl)benzoyl]amino]-2-methylene-4-oxo-butanoate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-[[2-[(ethylthio)methyl]phenyl]-oxomethyl]amino]-2-methylene-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(ethylsulfanylmethyl)benzoyl]amino]-2-methylidene-4-oxobutanoate Traditional Name: 2-[2-[[2-[(ethylthio)methyl]benzoyl]-homoveratryl-amino]-2-keto-ethyl]acrylic acid methyl ester Formula: C26H31NO6S MolecularWeight: 485.59244

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC=CC=C1C(=O)N(CCC2=CC(=C(C=C2)OC)OC)C(=O)CC(=C)C(=O)OC

Isomeric SMILES

CCSCC1=CC=CC=C1C(=O)N(CCC2=CC(=C(C=C2)OC)OC)C(=O)CC(=C)C(=O)OC

InChI

InChI=1S/C26H31NO6S/c1-6-34-17-20-9-7-8-10-21(20)25(29)27(24(28)15-18(2)26(30)33-5)14-13-19-11-12-22(31-3)23(16-19)32-4/h7-12,16H,2,6,13-15,17H2,1,3-5H3