methyl 3-(1-adamantylmethyl)-2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate

Systemtic Name: methyl 3-(1-adamantylmethyl)-2-(4-ethoxycarbonylphenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate Openeye Name: methyl 3-(1-adamantylmethyl)-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylate CAS Name: 3-(1-adamantylmethyl)-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(1-adamantylmethyl)-2-(4-ethoxycarbonylphenyl)imino-4-oxo-1,3-thiazine-6-carboxylate Traditional Name: 3-(1-adamantylmethyl)-2-(4-carbethoxyphenyl)imino-4-keto-1,3-thiazine-6-carboxylic acid methyl ester Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C=C(S2)C(=O)OC)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C=C(S2)C(=O)OC)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H30N2O5S/c1-3-33-23(30)19-4-6-20(7-5-19)27-25-28(22(29)11-21(34-25)24(31)32-2)15-26-12-16-8-17(13-26)10-18(9-16)14-26/h4-7,11,16-18H,3,8-10,12-15H2,1-2H3