Vitas-M small molecule compound
ethyl (2Z)-5-(2,4-dimethoxyphenyl)-3-oxo-7-phenyl-2-(pyridin-4-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL438413
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1OC)OC)c(=O)/c(=C/c1ccncc1)/s2)c1ccccc1
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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 C29H25N3O5S MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O5S/c1-4-37-28(34)24-25(19-8-6-5-7-9-19)31-29-32(26(24)21-11-10-20(35-2)17-22(21)36-3)27(33)23(38-29)16-18-12-14-30-15-13-18/h5-17,26H,4H2,1-3H3/b23-16-InChIKey
WWQOTFOTKKTTMR-KQWNVCNZSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1OC)OC)c(=O)c(=Cc1ccncc1)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=C(C=C(C=C3)OC)OC)C(=O)C(=CC4=CC=NC=C4)S2)C5=CC=CC=C5
ethyl(2Z)5(24dimethoxyphenyl)3oxo7phenyl2(pyridin4ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(24DIMETHOXYPHENYL)3OXO7PHENYL2(PYRIDIN4YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H25N3O5Sc143728(34)2425(198657919)312932(26(24)21111020(352)1722(21)363)27(33)23(3829)1618121430151318h51726H4H213H3b2316
MFCD06242112
ZINC000008695546
ZINC000008695547
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