Vitas-M small molecule compound
methyl (2E)-5-[4-(diethylamino)phenyl]-2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK305700
SMILES CCN(c1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1cnn(c1C)C)/s2)C(=O)OC)CC
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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 C25H29N5O3S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3S/c1-7-29(8-2)19-11-9-17(10-12-19)22-21(24(32)33-6)15(3)27-25-30(22)23(31)20(34-25)13-18-14-26-28(5)16(18)4/h9-14,22H,7-8H2,1-6H3/b20-13+InChIKey
GZSLRTQDSCXHIR-DEDYPNTBSA-NSynonyms
1005601-88-61005601886
CCN(c1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cnn(c1C)C)s2)C(=O)OC)CC
CCN(CC)C1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=C(N(N=C4)C)C)S3)C)C(=O)OC
InChI=1SC25H29N5O3Sc1729(82)1911917(101219)2221(24(32)336)15(3)272530(22)23(31)20(3425)1318142628(5)16(18)4h91422H78H216H3b2013+
methyl(2E)5(4(diethylamino)phenyl)2((15dimethyl1Hpyrazol4yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4(diethylamino)phenyl)2((15dimethylpyrazol4yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD04045905
ZINC000013959705
ZINC000013959706
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