Vitas-M small molecule compound
N-(heptan-2-yl)-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Catalog ID
STL537954
SMILES CCCCCC(NC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)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 C28H32N4O3 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3/c1-4-5-6-10-18(2)29-25(33)19-11-9-12-20(17-19)32-26(34)28(3)24-22(15-16-31(28)27(32)35)21-13-7-8-14-23(21)30-24/h7-9,11-14,17-18,30H,4-6,10,15-16H2,1-3H3,(H,29,33)/t18?,28-/m0/s1InChIKey
FIKUHVLJVBOTBQ-QGRUVSRESA-NSynonyms
956998-16-6~(N)heptan2yl3((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)benzamide
16400392
956998166
CCCCCC(NC(=O)c1cccc(c1)N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C
InChI=1SC28H32N4O3c14561018(2)2925(33)191191220(1719)3226(34)28(3)2422(151631(28)27(32)35)2113781423(21)3024h791114171830H46101516H213H3(H2933)t18?28m0s1
MFCD05671339
N(heptan2yl)3((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
N(heptan2yl)3((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
ZINC000008918199
ZINC000012864474
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