Vitas-M small molecule compound
2-(4-bromo-3-methyl-1H-pyrazol-1-yl)-N-(2-methyl-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Catalog ID
STK304162
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCCCCc1s2)Cn1nc(c(c1)Br)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 C19H22BrN5O2S MW 464.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22BrN5O2S/c1-11-14(20)9-24(22-11)10-16(26)23-25-12(2)21-18-17(19(25)27)13-7-5-3-4-6-8-15(13)28-18/h9H,3-8,10H2,1-2H3,(H,23,26)InChIKey
JBETYJCAVBYWMN-UHFFFAOYSA-NSynonyms
1005564-44-21005564442
2(4bromo3methyl1Hpyrazol1yl)N(2methyl4oxo5678910hexahydrocycloocta(45)thieno(23d)pyrimidin3(4H)yl)acetamide
2(4bromo3methylpyrazol1yl)N(2methyl4oxo5678910hexahydrocycloocta(23)thieno(24d)pyrimidin3yl)acetamide
CC1=NN(C=C1Br)CC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCCCCC4)C
InChI=1SC19H22BrN5O2Sc11114(20)924(2211)1016(26)232512(2)211817(19(25)27)1375346815(13)2818h9H3810H212H3(H2326)
MFCD04044731
ZINC000002780194
ZINC02780194
ZINC2780194
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