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

Systemtic Name: methyl 4-[[4-oxidanylidene-2-phenylimino-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[4-oxo-2-phenylimino-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[4-oxo-2-phenylimino-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-oxo-2-phenylimino-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[4-keto-2-phenylimino-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C28H27N3O4S MolecularWeight: 501.59668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CCCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4S/c1-35-27(34)21-14-16-23(17-15-21)29-26(33)24-19-25(32)31(18-8-11-20-9-4-2-5-10-20)28(36-24)30-22-12-6-3-7-13-22/h2-7,9-10,12-17,24H,8,11,18-19H2,1H3,(H,29,33)