Vitas-M small molecule compound
(2E)-5-(4-chlorophenyl)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL397525
SMILES Clc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1cn(nc1C)C)/s2)C(=O)Nc1ccccc1
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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 C26H22ClN5O2S MW 504.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O2S/c1-15-18(14-31(3)30-15)13-21-25(34)32-23(17-9-11-19(27)12-10-17)22(16(2)28-26(32)35-21)24(33)29-20-7-5-4-6-8-20/h4-14,23H,1-3H3,(H,29,33)/b21-13+InChIKey
HANXVFDKKPDYDJ-FYJGNVAPSA-NSynonyms
512818-19-8(2E)5(4CHLOROPHENYL)2((13DIMETHYL1HPYRAZOL4YL)METHYLIDENE)7METHYL3OXONPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(2E)5(4CHLOROPHENYL)2((13DIMETHYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXONPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
5(4CHLOROPHENYL)2((13DIMETHYL1HPYRAZOL4YL)METHYLENE)7METHYL3OXONPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
512818198
CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C)C)SC2=N1)C4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5
Clc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cn(nc1C)C)s2)C(=O)Nc1ccccc1
InChI=1SC26H22ClN5O2Sc11518(1431(3)3015)132125(34)3223(1791119(27)121017)22(16(2)2826(32)3521)24(33)29207546820h41423H13H3(H2933)b2113+
MFCD03468269
ZINC000000653690
ZINC000000653694
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