Vitas-M small molecule compound
ethyl (2E)-5-(4-ethoxyphenyl)-3-oxo-7-phenyl-2-(pyridin-3-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK063725
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OCC)c(=O)/c(=C\c1cccnc1)/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 C29H25N3O4S MW 511.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O4S/c1-3-35-22-14-12-21(13-15-22)26-24(28(34)36-4-2)25(20-10-6-5-7-11-20)31-29-32(26)27(33)23(37-29)17-19-9-8-16-30-18-19/h5-18,26H,3-4H2,1-2H3/b23-17+InChIKey
XCDMOFBFQNTJSR-HAVVHWLPSA-NSynonyms
434313-30-1434313301
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OCC)c(=O)c(=Cc1cccnc1)s2)c1ccccc1
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CN=CC=C4)S3)C5=CC=CC=C5)C(=O)OCC
ETHYL(2E)5(4ETHOXYPHENYL)3OXO7PHENYL2(PYRIDIN3YLMETHYLIDENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)5(4ethoxyphenyl)3oxo7phenyl2(pyridin3ylmethylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H25N3O4Sc133522141221(131522)2624(28(34)3642)25(20106571120)312932(26)27(33)23(3729)17199816301819h51826H34H212H3b2317+
MFCD02373958
STK063725
ZINC000009553719
ZINC000009553720
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