ethyl 4-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-2-phenylimino-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-2-phenylimino-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-2-phenylimino-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-2-phenylimino-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(3,4-dimethoxyphenyl)methyl]-4-oxo-2-phenylimino-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[(4-keto-2-phenylimino-3-veratryl-1,3-thiazinane-6-carbonyl)amino]benzoic acid ethyl ester Formula: C29H29N3O6S MolecularWeight: 547.62206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H29N3O6S/c1-4-38-28(35)20-11-13-22(14-12-20)30-27(34)25-17-26(33)32(29(39-25)31-21-8-6-5-7-9-21)18-19-10-15-23(36-2)24(16-19)37-3/h5-16,25H,4,17-18H2,1-3H3,(H,30,34)