Vitas-M small molecule compound

N-[3-(dimethylamino)propyl]-2-[(11bS)-8-methoxy-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
STL537141
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCCN(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 C27H31N5O4 MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O4/c1-27-23-18(20-16-17(36-4)10-11-21(20)29-23)12-15-31(27)26(35)32(25(27)34)22-9-6-5-8-19(22)24(33)28-13-7-14-30(2)3/h5-6,8-11,16,29H,7,12-15H2,1-4H3,(H,28,33)/t27-/m0/s1
InChIKey
XIECZEJRQIYTDX-MHZLTWQESA-N
Synonyms
956799-33-0
(S)N(3(dimethylamino)propyl)2(8methoxy11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)benzamide
~(N)(3(dimethylamino)propyl)2((2~(S))12methoxy2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)10(15)1113tetraen4yl)benzamide
6571052
956799330
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCCN(C)C
InChI=1SC27H31N5O4c1272318(201617(364)101121(20)2923)121531(27)26(35)32(25(27)34)22965819(22)24(33)281371430(2)3h568111629H71215H214H3(H2833)t27m0s1
MFCD05671692
N(3(dimethylamino)propyl)2((11bS)8methoxy11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)benzamide
ZINC000012865243
ZINC12865243

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Available files

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