Vitas-M small molecule compound
N-cyclohexyl-2-[(11aS)-5-methyl-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Catalog ID
STL532846
SMILES O=C(c1ccccc1N1C(=O)[C@H]2N(C1=O)C(C)c1c(C2)c2ccccc2[nH]1)NC1CCCCC1
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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 C27H28N4O3 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3/c1-16-24-20(18-11-5-7-13-21(18)29-24)15-23-26(33)31(27(34)30(16)23)22-14-8-6-12-19(22)25(32)28-17-9-3-2-4-10-17/h5-8,11-14,16-17,23,29H,2-4,9-10,15H2,1H3,(H,28,32)/t16?,23-/m0/s1InChIKey
JQDGAAZBELGTEK-KESSSICBSA-NSynonyms
956936-62-2~(N)cyclohexyl2((15~(S))10methyl1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16403918
956936622
InChI=1SC27H28N4O3c1162420(1811571321(18)2924)152326(33)31(27(34)30(16)23)2214861219(22)25(32)281793241017h58111416172329H2491015H21H3(H2832)t16?23m0s1
MFCD06765627
Ncyclohexyl2((11aS)5methyl13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
Ncyclohexyl2((11aS)5methyl13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
O=C(c1ccccc1N1C(=O)(C@H)2N(C1=O)C(C)c1c(C2)c2ccccc2(nH)1)NC1CCCCC1
ZINC000012882134
ZINC000012882142
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