Vitas-M small molecule compound

N-[2-(4-methoxyphenyl)ethyl]-2-[(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
STL537675
SMILES COc1ccc(cc1)CCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3

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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 C30H28N4O4 MW 508.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O4/c1-30-26-22(21-7-3-5-9-24(21)32-26)16-18-33(30)29(37)34(28(30)36)25-10-6-4-8-23(25)27(35)31-17-15-19-11-13-20(38-2)14-12-19/h3-14,32H,15-18H2,1-2H3,(H,31,35)/t30-/m0/s1
InChIKey
PNNJHQVWAOTMME-PMERELPUSA-N
Synonyms
956987-80-7
(S)N(4methoxyphenethyl)2(11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)(2(4methoxyphenyl)ethyl)2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)benzamide
6570313
956987807
COc1ccc(cc1)CCNC(=O)c1ccccc1N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3
InChI=1SC30H28N4O4c1302622(21735924(21)3226)161833(30)29(37)34(28(30)36)251064823(25)27(35)31171519111320(382)141219h31432H1518H212H3(H3135)t30m0s1
MFCD04146948
N(2(4methoxyphenyl)ethyl)2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
ZINC000008918008
ZINC8918008

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.