Vitas-M small molecule compound
4-{[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl}-2-(propan-2-yl)isoquinolin-1(2H)-one
Catalog ID
STL409790
SMILES O=C(c1cn(C(C)C)c(=O)c2c1cccc2)N1CCC(CC1)c1nc2c([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 C25H26N4O2 MW 414.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2/c1-16(2)29-15-20(18-7-3-4-8-19(18)25(29)31)24(30)28-13-11-17(12-14-28)23-26-21-9-5-6-10-22(21)27-23/h3-10,15-17H,11-14H2,1-2H3,(H,26,27)InChIKey
BNBSLKWICVRDHH-UHFFFAOYSA-NSynonyms
1574291-82-91574291829
4((4(1Hbenzimidazol2yl)piperidin1yl)carbonyl)2(propan2yl)isoquinolin1(2H)one
4(4(1Hbenzimidazol2yl)piperidine1carbonyl)2propan2ylisoquinolin1one
4(4(1Hbenzo(d)imidazol2yl)piperidine1carbonyl)2isopropylisoquinolin1(2H)one
CC(C)N1C=C(C2=CC=CC=C2C1=O)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4
InChI=1SC25H26N4O2c116(2)291520(18734819(18)25(29)31)24(30)28131117(121428)2326219561022(21)2723h3101517H1114H212H3(H2627)
MFCD28058156
O=C(c1cn(C(C)C)c(=O)c2c1cccc2)N1CCC(CC1)c1nc2c((nH)1)cccc2
ZINC000096223909
ZINC96223909
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