Vitas-M small molecule compound
3-{2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Catalog ID
STL475333
SMILES COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)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 C26H28N4O4 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4/c1-33-22-13-18-9-12-30(24(31)15-19(18)14-23(22)34-2)16-25(32)29-10-7-17(8-11-29)26-27-20-5-3-4-6-21(20)28-26/h3-6,9,12-14,17H,7-8,10-11,15-16H2,1-2H3,(H,27,28)InChIKey
LACGFFIDACATHL-UHFFFAOYSA-NSynonyms
1574327-78-81574327788
3(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)78dimethoxy13dihydro2H3benzazepin2one
3(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)78dimethoxy1H3benzazepin2one
3(2(4(1Hbenzo(d)imidazol2yl)piperidin1yl)2oxoethyl)78dimethoxy1Hbenzo(d)azepin2(3H)one
COC1=C(C=C2C=CN(C(=O)CC2=C1)CC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4)OC
COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)N1CCC(CC1)c1nc2c((nH)1)cccc2
InChI=1SC26H28N4O4c13322131891230(24(31)1519(18)1423(22)342)1625(32)2910717(81129)262720534621(20)2826h369121417H7810111516H212H3(H2728)
MFCD28052116
ZINC000096116571
ZINC96116571
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