Vitas-M small molecule compound
methyl (2Z)-2-(3-chloro-5-ethoxy-4-hydroxybenzylidene)-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK676880
SMILES CCOc1cc(cc(c1O)Cl)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OC)C
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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 C27H27ClN2O5S MW 527.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O5S/c1-6-35-20-12-16(11-19(28)24(20)31)13-21-25(32)30-23(18-9-7-17(8-10-18)14(2)3)22(26(33)34-5)15(4)29-27(30)36-21/h7-14,23,31H,6H2,1-5H3/b21-13-InChIKey
UJBQXTHBRJRFBE-BKUYFWCQSA-NSynonyms
CCOC1=C(C(=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)C(C)C)Cl)O
CCOc1cc(cc(c1O)Cl)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OC)C
InChI=1SC27H27ClN2O5Sc1635201216(1119(28)24(20)31)132125(32)3023(189717(81018)14(2)3)22(26(33)345)15(4)2927(30)3621h7142331H6H215H3b2113
METHYL(2Z)2((3CHLORO5ETHOXY4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(3chloro5ethoxy4hydroxybenzylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD02647459
ZINC000015218957
ZINC000015218959
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