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

Systemtic Name: methyl 4-[[2-(4-methoxyphenyl)imino-4-oxidanylidene-3-phenethyl-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(4-methoxyphenyl)imino-4-oxo-3-phenethyl-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-methoxyphenyl)imino-4-oxo-3-phenethyl-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-methoxyphenyl)imino-4-oxo-3-phenethyl-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[4-keto-2-(4-methoxyphenyl)imino-3-phenethyl-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C28H27N3O5S MolecularWeight: 517.59608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O5S/c1-35-23-14-12-22(13-15-23)30-28-31(17-16-19-6-4-3-5-7-19)25(32)18-24(37-28)26(33)29-21-10-8-20(9-11-21)27(34)36-2/h3-15,24H,16-18H2,1-2H3,(H,29,33)