Vitas-M small molecule compound
methyl (2E)-5-[4-(diethylamino)phenyl]-2-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL403385
SMILES CCn1cc(c(n1)C)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(cc1)N(CC)CC)C(=O)OC)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 C26H31N5O3S MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O3S/c1-7-29(8-2)20-12-10-18(11-13-20)23-22(25(33)34-6)17(5)27-26-31(23)24(32)21(35-26)14-19-15-30(9-3)28-16(19)4/h10-15,23H,7-9H2,1-6H3/b21-14+InChIKey
PDNGSODLRYLQKX-KGENOOAVSA-NSynonyms
1005571-20-91005571209
CCN1C=C(C(=N1)C)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)N(CC)CC
CCn1cc(c(n1)C)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)N(CC)CC)C(=O)OC)C
InChI=1SC26H31N5O3Sc1729(82)20121018(111320)2322(25(33)346)17(5)272631(23)24(32)21(3526)14191530(93)2816(19)4h101523H79H216H3b2114+
methyl(2E)5(4(diethylamino)phenyl)2((1ethyl3methyl1Hpyrazol4yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4(diethylamino)phenyl)2((1ethyl3methylpyrazol4yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD04136457
ZINC000002806539
ZINC000002806541
Check stock
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Check stock on Vitas-MAvailable files
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