dimethyl (2S)-2-[(4Z)-4-[(4-methoxyphenyl)methylidene]-2-methylsulfanyl-5-oxidanylidene-imidazol-1-yl]pentanedioate

Systemtic Name: dimethyl (2S)-2-[(4Z)-4-[(4-methoxyphenyl)methylidene]-2-methylsulfanyl-5-oxidanylidene-imidazol-1-yl]pentanedioate Openeye Name: dimethyl (2S)-2-[(4Z)-4-[(4-methoxyphenyl)methylene]-2-methylsulfanyl-5-oxo-imidazol-1-yl]pentanedioate CAS Name: (2S)-2-[(4Z)-4-[(4-methoxyphenyl)methylidene]-2-(methylthio)-5-oxo-1-imidazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[(4Z)-4-[(4-methoxyphenyl)methylidene]-2-methylsulfanyl-5-oxoimidazol-1-yl]pentanedioate Traditional Name: (2S)-2-[(4Z)-5-keto-2-(methylthio)-4-p-anisylidene-2-imidazolin-1-yl]glutaric acid dimethyl ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C2C(=O)N(C(=N2)SC)C(CCC(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=N2)SC)[C@@H](CCC(=O)OC)C(=O)OC

InChI

InChI=1S/C19H22N2O6S/c1-25-13-7-5-12(6-8-13)11-14-17(23)21(19(20-14)28-4)15(18(24)27-3)9-10-16(22)26-2/h5-8,11,15H,9-10H2,1-4H3/b14-11-/t15-/m0/s1