methyl 3-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate

Systemtic Name: methyl 3-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate Openeye Name: methyl 3-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylate CAS Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylate Traditional Name: 2-(4-carbethoxyphenyl)imino-3-[2-(3,4-diethoxyphenyl)ethyl]-4-keto-1,3-thiazine-6-carboxylic acid methyl ester Formula: C27H30N2O7S MolecularWeight: 526.6013

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCN2C(=O)C=C(SC2=NC3=CC=C(C=C3)C(=O)OCC)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCN2C(=O)C=C(SC2=NC3=CC=C(C=C3)C(=O)OCC)C(=O)OC)OCC

InChI

InChI=1S/C27H30N2O7S/c1-5-34-21-13-8-18(16-22(21)35-6-2)14-15-29-24(30)17-23(26(32)33-4)37-27(29)28-20-11-9-19(10-12-20)25(31)36-7-3/h8-13,16-17H,5-7,14-15H2,1-4H3