Vitas-M small molecule compound
3,4-dihydro-2H-1,5-benzodioxepin-7-yl[(2S)-2-(1-methyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methanone
Catalog ID
STL409922
SMILES O=C(N1CCC[C@H]1c1nc2c(n1C)cccc2)c1ccc2c(c1)OCCCO2
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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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c1-24-17-7-3-2-6-16(17)23-21(24)18-8-4-11-25(18)22(26)15-9-10-19-20(14-15)28-13-5-12-27-19/h2-3,6-7,9-10,14,18H,4-5,8,11-13H2,1H3/t18-/m0/s1InChIKey
QJOKRNKXMVTMEL-SFHVURJKSA-NSynonyms
1574359-85-5(S)(34dihydro2Hbenzo(b)(14)dioxepin7yl)(2(1methyl1Hbenzo(d)imidazol2yl)pyrrolidin1yl)methanone
1574359855
34dihydro2H15benzodioxepin7yl((2S)2(1methyl1Hbenzimidazol2yl)pyrrolidin1yl)methanone
34dihydro2H15benzodioxepin7yl((2S)2(1methylbenzimidazol2yl)pyrrolidin1yl)methanone
CN1C2=CC=CC=C2N=C1C3CCCN3C(=O)C4=CC5=C(C=C4)OCCCO5
InChI=1SC22H23N3O3c12417732616(17)2321(24)18841125(18)22(26)159101920(1415)28135122719h23679101418H4581113H21H3t18m0s1
O=C(N1CCC(C@H)1c1nc2c(n1C)cccc2)c1ccc2c(c1)OCCCO2
ZINC000068002261
ZINC68002261
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