methyl 6-(4-hexoxyphenyl)-8-methyl-4-oxidanylidene-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate

Systemtic Name: methyl 6-(4-hexoxyphenyl)-8-methyl-4-oxidanylidene-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate Openeye Name: methyl 6-(4-hexoxyphenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate CAS Name: 6-(4-hexoxyphenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid methyl ester IUPAC Name: methyl 6-(4-hexoxyphenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate Traditional Name: 6-(4-hexoxyphenyl)-4-keto-8-methyl-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid methyl ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-5-6-7-13-28-17-10-8-16(9-11-17)20-19(21(26)27-3)15(2)23-22-24(20)18(25)12-14-29-22/h8-11,20H,4-7,12-14H2,1-3H3