Vitas-M small molecule compound
N-[5-(1H-benzimidazol-2-yl)pentyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL408780
SMILES O=C(c1ccc2c(c1)OCCCO2)NCCCCCc1nc2c([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 C22H25N3O3 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3/c26-22(16-10-11-19-20(15-16)28-14-6-13-27-19)23-12-5-1-2-9-21-24-17-7-3-4-8-18(17)25-21/h3-4,7-8,10-11,15H,1-2,5-6,9,12-14H2,(H,23,26)(H,24,25)InChIKey
GMPNZPVBMHFEME-UHFFFAOYSA-NSynonyms
1574310-25-01574310250
C1COC2=C(C=C(C=C2)C(=O)NCCCCCC3=NC4=CC=CC=C4N3)OC1
InChI=1SC22H25N3O3c2622(1610111920(1516)28146132719)23125129212417734818(17)2521h3478101115H125691214H2(H2326)(H2425)
MFCD28057772
N(5(1Hbenzimidazol2yl)pentyl)34dihydro2H15benzodioxepine7carboxamide
N(5(1Hbenzo(d)imidazol2yl)pentyl)34dihydro2Hbenzo(b)(14)dioxepine7carboxamide
O=C(c1ccc2c(c1)OCCCO2)NCCCCCc1nc2c((nH)1)cccc2
ZINC000096118854
ZINC96118854
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