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

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

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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)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4S/c1-2-35-27(34)21-13-15-23(16-14-21)29-26(33)24-19-25(32)31(18-17-20-9-5-3-6-10-20)28(36-24)30-22-11-7-4-8-12-22/h3-16,24H,2,17-19H2,1H3,(H,29,33)