ethyl 4-[[4-oxidanylidene-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazin-6-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-oxidanylidene-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazin-6-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[(3-benzyl-2-benzylimino-4-oxo-1,3-thiazine-6-carbonyl)amino]benzoate CAS Name: 4-[[oxo-[4-oxo-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazin-6-yl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-benzyl-2-benzylimino-4-oxo-1,3-thiazine-6-carbonyl)amino]benzoate Traditional Name: 4-[(3-benzyl-2-benzylimino-4-keto-1,3-thiazine-6-carbonyl)amino]benzoic acid ethyl ester Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=O)N(C(=NCC3=CC=CC=C3)S2)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=O)N(C(=NCC3=CC=CC=C3)S2)CC4=CC=CC=C4

InChI

InChI=1S/C28H25N3O4S/c1-2-35-27(34)22-13-15-23(16-14-22)30-26(33)24-17-25(32)31(19-21-11-7-4-8-12-21)28(36-24)29-18-20-9-5-3-6-10-20/h3-17H,2,18-19H2,1H3,(H,30,33)