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

Systemtic Name: methyl 4-[[4-oxidanylidene-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazin-6-yl]carbonylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C27H23N3O4S MolecularWeight: 485.55422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=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/C27H23N3O4S/c1-34-26(33)21-12-14-22(15-13-21)29-25(32)23-16-24(31)30(18-20-10-6-3-7-11-20)27(35-23)28-17-19-8-4-2-5-9-19/h2-16H,17-18H2,1H3,(H,29,32)