Vitas-M small molecule compound
N'-[(1E)-1-(1,3-dimethyl-1H-pyrazol-4-yl)ethylidene]-2-(4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)propanehydrazide
Catalog ID
STL402684
SMILES O=C(C(n1cnc2c(c1=O)c1CCCc1s2)C)N/N=C(/c1cn(nc1C)C)\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 C19H22N6O2S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O2S/c1-10(14-8-24(4)23-11(14)2)21-22-17(26)12(3)25-9-20-18-16(19(25)27)13-6-5-7-15(13)28-18/h8-9,12H,5-7H2,1-4H3,(H,22,26)/b21-10+InChIKey
BOLPGOYAIKPNFS-UFFVCSGVSA-NSynonyms
1041668-56-71041668567
CC1=NN(C=C1C(=NNC(=O)C(C)N2C=NC3=C(C2=O)C4=C(S3)CCC4)C)C
InChI=1SC19H22N6O2Sc110(14824(4)2311(14)2)212217(26)12(3)259201816(19(25)27)1365715(13)2818h8912H57H214H3(H2226)b2110+
MFCD04132347
N((1E)1(13dimethyl1Hpyrazol4yl)ethylidene)2(4oxo67dihydro4Hcyclopenta(45)thieno(23d)pyrimidin3(5H)yl)propanehydrazide
N((E)1(13dimethylpyrazol4yl)ethylideneamino)2(1oxo78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin2yl)propanamide
O=C(C(n1cnc2c(c1=O)c1CCCc1s2)C)NN=C(c1cn(nc1C)C)C
ZINC000006921395
ZINC000006921398
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