Vitas-M small molecule compound
ethyl (2Z)-2-(2-hydroxybenzylidene)-7-methyl-3-oxo-5-(2-propoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK102720
SMILES CCCOc1ccccc1C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccccc1O)/s2)C(=O)OCC
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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 C26H26N2O5S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O5S/c1-4-14-33-20-13-9-7-11-18(20)23-22(25(31)32-5-2)16(3)27-26-28(23)24(30)21(34-26)15-17-10-6-8-12-19(17)29/h6-13,15,23,29H,4-5,14H2,1-3H3/b21-15-InChIKey
ZERDZRABCISNGN-QNGOZBTKSA-NSynonyms
CCCOC1=CC=CC=C1C2C(=C(N=C3N2C(=O)C(=CC4=CC=CC=C4O)S3)C)C(=O)OCC
CCCOc1ccccc1C1C(=C(C)N=c2n1c(=O)c(=Cc1ccccc1O)s2)C(=O)OCC
ETHYL(2Z)2((2HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5(2PROPOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(2HYDROXYBENZYLIDENE)7METHYL3OXO5(2PROPOXYPHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H26N2O5Sc1414332013971118(20)2322(25(31)3252)16(3)272628(23)24(30)21(3426)151710681219(17)29h613152329H4514H213H3b2115
MFCD03145557
ZINC000002994116
ZINC000002994118
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