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

Systemtic Name: methyl 4-[[2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(4-ethoxycarbonylphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-ethoxycarbonylphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-ethoxycarbonylphenyl)imino-4-oxo-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[2-(4-carbethoxyphenyl)imino-4-keto-3-(3-phenylpropyl)-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C31H31N3O6S MolecularWeight: 573.65934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)C(=O)OC)CCCC4=CC=CC=C4

InChI

InChI=1S/C31H31N3O6S/c1-3-40-30(38)23-13-17-25(18-14-23)33-31-34(19-7-10-21-8-5-4-6-9-21)27(35)20-26(41-31)28(36)32-24-15-11-22(12-16-24)29(37)39-2/h4-6,8-9,11-18,26H,3,7,10,19-20H2,1-2H3,(H,32,36)