Vitas-M small molecule compound

2-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-(prop-2-en-1-yl)benzamide

Catalog ID
STL530703
SMILES C=CCNC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)OC)c1c(C2)c2ccccc2[nH]1

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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 C30H26N4O4 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O4/c1-3-15-31-28(35)21-12-5-7-14-24(21)34-29(36)25-17-22-20-11-4-6-13-23(20)32-26(22)27(33(25)30(34)37)18-9-8-10-19(16-18)38-2/h3-14,16,25,27,32H,1,15,17H2,2H3,(H,31,35)/t25-,27?/m0/s1
InChIKey
ABMJPBLELMUCGW-PVCWFJFTSA-N
Synonyms
956992-44-2
16402546
2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(prop2en1yl)benzamide
2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)prop2enylbenzamide
956992442
C=CCNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC30H26N4O4c13153128(35)2112571424(21)3429(36)2517222011461323(20)3226(22)27(33(25)30(34)37)18981019(1618)382h31416252732H11517H22H3(H3135)t2527?m0s1
MFCD06493893
Nallyl2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
ZINC000002161341
ZINC000002161344

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Available files

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