Vitas-M small molecule compound
3-{[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]carbonyl}-8-chloroquinolin-4(1H)-one
Catalog ID
STL407860
SMILES O=C(c1c[nH]c2c(c1=O)cccc2Cl)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 C21H17ClN4O2 MW 392.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O2/c22-14-6-3-5-12-18(14)23-11-13(19(12)27)21(28)26-10-4-9-17(26)20-24-15-7-1-2-8-16(15)25-20/h1-3,5-8,11,17H,4,9-10H2,(H,23,27)(H,24,25)InChIKey
AJUXJVLZBDFPMF-UHFFFAOYSA-NSynonyms
3((2(1Hbenzimidazol2yl)pyrrolidin1yl)carbonyl)8chloroquinolin4(1H)one
3(2(1Hbenzimidazol2yl)pyrrolidine1carbonyl)8chloro1Hquinolin4one
C1CC(N(C1)C(=O)C2=CNC3=C(C2=O)C=CC=C3Cl)C4=NC5=CC=CC=C5N4
InChI=1SC21H17ClN4O2c22146351218(14)231113(19(12)27)21(28)26104917(26)202415712816(15)2520h13581117H4910H2(H2327)(H2425)
MFCD30704939
O=C(c1c(nH)c2c(c1=O)cccc2Cl)N1CCCC1c1nc2c((nH)1)cccc2
ZINC000096232244
ZINC000206251369
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