methyl 4-[[2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[3-benzyl-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-ethoxycarbonylphenyl)imino-4-oxo-3-(phenylmethyl)-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-benzyl-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[3-benzyl-2-(4-carbethoxyphenyl)imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C29H27N3O6S MolecularWeight: 545.60618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C29H27N3O6S/c1-3-38-28(36)21-11-15-23(16-12-21)31-29-32(18-19-7-5-4-6-8-19)25(33)17-24(39-29)26(34)30-22-13-9-20(10-14-22)27(35)37-2/h4-16,24H,3,17-18H2,1-2H3,(H,30,34)