Vitas-M small molecule compound
9-methoxy-N-(3-{[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]carbamoyl}phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL542383
SMILES COc1cc(cc2c1OCCCO2)C(=O)Nc1cccc(c1)C(=O)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C28H35N3O5 MW 493.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O5/c1-34-24-16-21(17-25-26(24)36-14-6-13-35-25)28(33)30-22-9-4-7-19(15-22)27(32)29-18-20-8-5-12-31-11-3-2-10-23(20)31/h4,7,9,15-17,20,23H,2-3,5-6,8,10-14,18H2,1H3,(H,29,32)(H,30,33)/t20-,23+/m0/s1InChIKey
QYKBEYKELCTBJV-NZQKXSOJSA-NSynonyms
1574400-27-3~(N)(3(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylcarbamoyl)phenyl)6methoxy34dihydro2~(H)15benzodioxepine8carboxamide
1574400273
71825495
9methoxyN(3((((1S9aR)octahydro1Hquinolizin1yl)methyl)carbamoyl)phenyl)34dihydro2Hbenzo(b)(14)dioxepine7carboxamide
9methoxyN(3(((1S9aR)octahydro2Hquinolizin1ylmethyl)carbamoyl)phenyl)34dihydro2H15benzodioxepine7carboxamide
COc1cc(cc2c1OCCCO2)C(=O)Nc1cccc(c1)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC28H35N3O5c134241621(172526(24)36146133525)28(33)302294719(1522)27(32)29182085123111321023(20)31h47915172023H23568101418H21H3(H2932)(H3033)t2023+m0s1
ZINC000096116524
ZINC96116524
Check stock
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