Vitas-M small molecule compound
N-[1-(cyclooctylamino)-3-methyl-1-oxobutan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL349984
SMILES COc1cc2CN(CCc2cc1OC)C(=O)NC(C(=O)NC1CCCCCCC1)C(C)C
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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 C25H39N3O4 MW 445.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H39N3O4/c1-17(2)23(24(29)26-20-10-8-6-5-7-9-11-20)27-25(30)28-13-12-18-14-21(31-3)22(32-4)15-19(18)16-28/h14-15,17,20,23H,5-13,16H2,1-4H3,(H,26,29)(H,27,30)InChIKey
QVDHCANPWDASRU-UHFFFAOYSA-NSynonyms
(S)N(1(cyclooctylamino)3methyl1oxobutan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
CC(C)C(C(=O)NC1CCCCCCC1)NC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC
COc1cc2CN(CCc2cc1OC)C(=O)N(C@H)(C(=O)NC1CCCCCCC1)C(C)C
InChI=1SC25H39N3O4c117(2)23(24(29)262010865791120)2725(30)281312181421(313)22(324)1519(18)1628h1415172023H51316H214H3(H2629)(H2730)
MFCD28032321
N(1(cyclooctylamino)3methyl1oxobutan2yl)67dimethoxy34dihydro1Hisoquinoline2carboxamide
N(1(cyclooctylamino)3methyl1oxobutan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
ZINC000009183788
ZINC000095471244
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