ethyl 2-[(4-fluorophenyl)carbamoyl]-8-methyl-4-oxidanylidene-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate

Systemtic Name: ethyl 2-[(4-fluorophenyl)carbamoyl]-8-methyl-4-oxidanylidene-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate Openeye Name: ethyl 2-[(4-fluorophenyl)carbamoyl]-8-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate CAS Name: 2-[(4-fluoroanilino)-oxomethyl]-8-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-fluorophenyl)carbamoyl]-8-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate Traditional Name: 2-[(4-fluorophenyl)carbamoyl]-4-keto-8-methyl-6-(3,4,5-trimethoxyphenyl)-6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid ethyl ester Formula: C27H26FN3O7S MolecularWeight: 555.574643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)C=C(S2)C(=O)NC4=CC=C(C=C4)F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)C=C(S2)C(=O)NC4=CC=C(C=C4)F)C

InChI

InChI=1S/C27H26FN3O7S/c1-6-38-26(34)22-14(2)29-27-31(23(22)15-11-18(35-3)24(37-5)19(12-15)36-4)21(32)13-20(39-27)25(33)30-17-9-7-16(28)8-10-17/h7-13,23H,6H2,1-5H3,(H,30,33)