Vitas-M small molecule compound
propan-2-yl (2Z)-2-(2,3-dimethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698101
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cccc(c1OC)OC)/s2)C(=O)OC(C)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 C27H28N2O6S MW 508.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O6S/c1-15(2)35-26(31)22-16(3)28-27-29(23(22)17-10-12-19(32-4)13-11-17)25(30)21(36-27)14-18-8-7-9-20(33-5)24(18)34-6/h7-15,23H,1-6H3/b21-14-InChIKey
CQKLTZUKVLMVEH-STZFKDTASA-NSynonyms
(Z)isopropyl2(23dimethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=C(C(=CC=C3)OC)OC)SC2=N1)C4=CC=C(C=C4)OC)C(=O)OC(C)C
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cccc(c1OC)OC)s2)C(=O)OC(C)C
InChI=1SC27H28N2O6Sc115(2)3526(31)2216(3)282729(23(22)17101219(324)131117)25(30)21(3627)141887920(335)24(18)346h71523H16H3b2114
MFCD02994895
PROPAN2YL(2Z)2((23DIMETHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
propan2yl(2Z)2(23dimethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000001251969
ZINC000001251971
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