Vitas-M small molecule compound
methyl 2-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-6-(4-methoxyphenyl)-8-methyl-4-oxo-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK174596
SMILES CCOC(=O)c1ccc(cc1)NC(=O)c1cc(=O)n2c(=NC(=C(C2c2ccc(cc2)OC)C(=O)OC)C)s1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H25N3O7S MW 535.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O7S/c1-5-37-25(33)17-6-10-18(11-7-17)29-24(32)20-14-21(31)30-23(16-8-12-19(35-3)13-9-16)22(26(34)36-4)15(2)28-27(30)38-20/h6-14,23H,5H2,1-4H3,(H,29,32)InChIKey
SMCWYCKNPNXEHU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)OC
InChI=1SC27H25N3O7Sc153725(33)1761018(11717)2924(32)201421(31)3023(1681219(353)13916)22(26(34)364)15(2)2827(30)3820h61423H5H214H3(H2932)
METHYL2((4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)6(4METHOXYPHENYL)8METHYL4OXO4H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
METHYL2((4ETHOXYCARBONYLPHENYL)CARBAMOYL)6(4METHOXYPHENYL)8METHYL4OXO6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
MFCD04062043
ZINC000001441580
ZINC000001441581
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