Vitas-M small molecule compound
ethyl 2-[(4-chlorophenyl)carbamoyl]-6-(2,3-dimethoxybenzyl)-8-methyl-4-oxo-4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK174602
SMILES CCOC(=O)C1=C(C)N=c2n(C1Cc1cccc(c1OC)OC)c(=O)cc(s2)C(=O)Nc1ccc(cc1)Cl
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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 C27H26ClN3O6S MW 556.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O6S/c1-5-37-26(34)23-15(2)29-27-31(19(23)13-16-7-6-8-20(35-3)24(16)36-4)22(32)14-21(38-27)25(33)30-18-11-9-17(28)10-12-18/h6-12,14,19H,5,13H2,1-4H3,(H,30,33)InChIKey
WDKDRQPLRDTEJR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N(C1CC3=C(C(=CC=C3)OC)OC)C(=O)C=C(S2)C(=O)NC4=CC=C(C=C4)Cl)C
ETHYL2((4CHLOROPHENYL)CARBAMOYL)6((23DIMETHOXYPHENYL)METHYL)8METHYL4OXO6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
ETHYL2((4CHLOROPHENYL)CARBAMOYL)6(23DIMETHOXYBENZYL)8METHYL4OXO4H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
InChI=1SC27H26ClN3O6Sc153726(34)2315(2)292731(19(23)131676820(353)24(16)364)22(32)1421(3827)25(33)301811917(28)101218h6121419H513H214H3(H3033)
MFCD04139584
ZINC000001442113
ZINC000001442114
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