Vitas-M small molecule compound
2-[5-(4-methylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzoic acid
Catalog ID
STL466459
SMILES Cc1ccc(cc1)C1N2C(Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O
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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 C27H21N3O4 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4/c1-15-10-12-16(13-11-15)24-23-19(17-6-2-4-8-20(17)28-23)14-22-25(31)30(27(34)29(22)24)21-9-5-3-7-18(21)26(32)33/h2-13,22,24,28H,14H2,1H3,(H,32,33)InChIKey
KGFKTBGYKGVLBC-UHFFFAOYSA-NSynonyms
2((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzoicacid
2(13diketo10(ptolyl)3a4910tetrahydroimidazo(15b)$bcarbolin2yl)benzoicacid
2(5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzoicacid
CC1=CC=C(C=C1)C2C3=C(CC4N2C(=O)N(C4=O)C5=CC=CC=C5C(=O)O)C6=CC=CC=C6N3
Cc1ccc(cc1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O
Cc1ccc(cc1)C1N2C(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O
InChI=1SC27H21N3O4c115101216(131115)242319(17624820(17)2823)142225(31)30(27(34)29(22)24)21953718(21)26(32)33h213222428H14H21H3(H3233)
MFCD10007632
ZINC000002135475
ZINC000011766835
Check stock
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Check stock on Vitas-MAvailable files
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