Vitas-M small molecule compound

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

Catalog ID
STL530962
SMILES COc1ccccc1CNC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)Cl)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 C34H27ClN4O4 MW 591.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27ClN4O4/c1-43-29-16-7-2-9-21(29)19-36-32(40)24-13-4-6-15-27(24)39-33(41)28-18-25-23-12-3-5-14-26(23)37-30(25)31(38(28)34(39)42)20-10-8-11-22(35)17-20/h2-17,28,31,37H,18-19H2,1H3,(H,36,40)/t28-,31?/m0/s1
InChIKey
AZWHATKGWUGHPC-NPHAVVRNSA-N
Synonyms
956994-37-9
16406269
2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N(2methoxybenzyl)benzamide
2((11aS)5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(2methoxybenzyl)benzamide
2((15~(S))10(3chlorophenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)((2methoxyphenyl)methyl)benzamide
956994379
COc1ccccc1CNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)Cl)c1c(C2)c2ccccc2(nH)1
InChI=1SC34H27ClN4O4c143291672921(29)193632(40)2413461527(24)3933(41)2818252312351426(23)3730(25)31(38(28)34(39)42)201081122(35)1720h217283137H1819H21H3(H3640)t2831?m0s1
ZINC000070707403
ZINC000070707406

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Available files

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