Vitas-M small molecule compound
ethyl (2Z)-7-methyl-3-oxo-2-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698393
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(o1)N1CCCCC1)/s2
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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 C29H33N3O4S MW 519.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O4S/c1-5-35-28(34)25-19(4)30-29-32(26(25)21-11-9-20(10-12-21)18(2)3)27(33)23(37-29)17-22-13-14-24(36-22)31-15-7-6-8-16-31/h9-14,17-18,26H,5-8,15-16H2,1-4H3/b23-17-InChIKey
XLKYENZVOPGALZ-QJOMJCCJSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(o1)N1CCCCC1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(O4)N5CCCCC5)S2)C
ethyl(2Z)7methyl3oxo2((5(piperidin1yl)furan2yl)methylidene)5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL3OXO2((5PIPERIDIN1YLFURAN2YL)METHYLIDENE)5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H33N3O4Sc153528(34)2519(4)302932(26(25)2111920(101221)18(2)3)27(33)23(3729)1722131424(3622)31157681631h914171826H581516H214H3b2317
MFCD01872154
ZINC000002186299
ZINC000002186301
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