3-[(3,4-dimethoxyphenyl)methyl]-N-(4-iodophenyl)-2-(4-methoxyphenyl)imino-4-oxidanylidene-1,3-thiazinane-6-carboxamide

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-N-(4-iodophenyl)-2-(4-methoxyphenyl)imino-4-oxidanylidene-1,3-thiazinane-6-carboxamide Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-N-(4-iodophenyl)-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-N-(4-iodophenyl)-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-N-(4-iodophenyl)-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide Traditional Name: N-(4-iodophenyl)-4-keto-2-(4-methoxyphenyl)imino-3-veratryl-1,3-thiazinane-6-carboxamide Formula: C27H26IN3O5S MolecularWeight: 631.48191

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)I)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)I)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H26IN3O5S/c1-34-21-11-9-20(10-12-21)30-27-31(16-17-4-13-22(35-2)23(14-17)36-3)25(32)15-24(37-27)26(33)29-19-7-5-18(28)6-8-19/h4-14,24H,15-16H2,1-3H3,(H,29,33)