Vitas-M small molecule compound
N-(1-{2-[(6R,13S)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-2-oxoethyl}-1H-indol-4-yl)acetamide
Catalog ID
STL548764
SMILES CC(=O)Nc1cccc2c1ccn2CC(=O)N1CCCC2=C[C@@H]3C[C@H](C12)CN1CCCCC31
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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 C27H34N4O2 MW 446.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O2/c1-18(32)28-23-7-4-9-25-22(23)10-13-30(25)17-26(33)31-12-5-6-19-14-20-15-21(27(19)31)16-29-11-3-2-8-24(20)29/h4,7,9-10,13-14,20-21,24,27H,2-3,5-6,8,11-12,15-17H2,1H3,(H,28,32)/t20-,21+,24?,27?/m0/s1InChIKey
IKBQBFFWOBRDLO-ZHVAVUFQSA-NSynonyms
CC(=O)Nc1cccc2c1ccn2CC(=O)N1CCCC2=C(C@H)3C(C@H)(C12)CN1CCCCC31
InChI=1SC27H34N4O2c118(32)28237492522(23)101330(25)1726(33)3112561914201521(27(19)31)16291132824(20)29h47910131420212427H2356811121517H21H3(H2832)t2021+24?27?m0s1
N(1(2((6R13R)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)2oxoethyl)1Hindol4yl)acetamide
N(1(2((6R13S)34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl)2oxoethyl)1Hindol4yl)acetamide
ZINC000409414212
ZINC000409414215
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