ethyl 4-[[2-(4-methoxyphenyl)imino-4-oxidanylidene-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[2-(4-methoxyphenyl)imino-4-oxidanylidene-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-(4-methoxyphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-methoxyphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-methoxyphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[4-keto-2-(4-methoxyphenyl)imino-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoic acid ethyl ester Formula: C30H31N3O5S MolecularWeight: 545.64924

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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=C(C=C3)OC)S2)CCCC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C30H31N3O5S/c1-3-38-29(36)22-11-13-23(14-12-22)31-28(35)26-20-27(34)33(19-7-10-21-8-5-4-6-9-21)30(39-26)32-24-15-17-25(37-2)18-16-24/h4-6,8-9,11-18,26H,3,7,10,19-20H2,1-2H3,(H,31,35)