Vitas-M small molecule compound
3-{[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]carbonyl}-8-methoxyquinolin-4(1H)-one
Catalog ID
STL422929
SMILES COc1cccc2c1[nH]cc(c2=O)C(=O)N1CCCC1c1nc2c([nH]1)cccc2
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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 C22H20N4O3 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3/c1-29-18-10-4-6-13-19(18)23-12-14(20(13)27)22(28)26-11-5-9-17(26)21-24-15-7-2-3-8-16(15)25-21/h2-4,6-8,10,12,17H,5,9,11H2,1H3,(H,23,27)(H,24,25)InChIKey
BNQCXHDDUQAEKK-UHFFFAOYSA-NSynonyms
3((2(1Hbenzimidazol2yl)pyrrolidin1yl)carbonyl)8methoxyquinolin4(1H)one
3(2(1Hbenzimidazol2yl)pyrrolidine1carbonyl)8methoxy1Hquinolin4one
COC1=CC=CC2=C1NC=C(C2=O)C(=O)N3CCCC3C4=NC5=CC=CC=C5N4
COc1cccc2c1(nH)cc(c2=O)C(=O)N1CCCC1c1nc2c((nH)1)cccc2
InChI=1SC22H20N4O3c1291810461319(18)231214(20(13)27)22(28)26115917(26)212415723816(15)2521h2468101217H5911H21H3(H2327)(H2425)
MFCD30708448
ZINC000096223217
ZINC000253496386
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