Vitas-M small molecule compound
methyl 4-({[1-(propan-2-yl)-1,5,6,7-tetrahydrocyclopenta[b]pyrazolo[4,3-e]pyridin-4-yl]carbonyl}amino)benzoate
Catalog ID
STK941239
SMILES COC(=O)c1ccc(cc1)NC(=O)c1c2CCCc2nc2c1cnn2C(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 C21H22N4O3 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3/c1-12(2)25-19-16(11-22-25)18(15-5-4-6-17(15)24-19)20(26)23-14-9-7-13(8-10-14)21(27)28-3/h7-12H,4-6H2,1-3H3,(H,23,26)InChIKey
FXGWVUKROXCGBS-UHFFFAOYSA-NSynonyms
1190250-05-51190250055
CC(C)N1C2=NC3=C(CCC3)C(=C2C=N1)C(=O)NC4=CC=C(C=C4)C(=O)OC
InChI=1SC21H22N4O3c112(2)251916(112225)18(1554617(15)2419)20(26)23149713(81014)21(27)283h712H46H213H3(H2326)
methyl4(((1(propan2yl)1567tetrahydrocyclopenta(b)pyrazolo(43e)pyridin4yl)carbonyl)amino)benzoate
methyl4(1isopropyl1567tetrahydrocyclopenta(b)pyrazolo(43e)pyridine4carboxamido)benzoate
MFCD13759882
ZINC000036360773
ZINC36360773
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