Vitas-M small molecule compound
methyl 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]benzoate
Catalog ID
STL458059
SMILES COC(=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 C27H20ClN3O4 MW 485.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O4/c1-35-26(33)18-10-3-5-12-21(18)31-25(32)22-14-19-17-9-2-4-11-20(17)29-23(19)24(30(22)27(31)34)15-7-6-8-16(28)13-15/h2-13,22,24,29H,14H2,1H3/t22-,24?/m0/s1InChIKey
ISYMECMDAGTCIO-OWJIYDKWSA-NSynonyms
956956-64-22((3aS)10(3chlorophenyl)13diketo3a4910tetrahydroimidazo(15b)$bcarbolin2yl)benzoicacidmethylester
956956642
COC(=O)C1=CC=CC=C1N2C(=O)C3CC4=C(C(N3C2=O)C5=CC(=CC=C5)Cl)NC6=CC=CC=C46
COC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)Cl)c1c(C2)c2ccccc2(nH)1
InChI=1SC27H20ClN3O4c13526(33)1810351221(18)3125(32)221419179241120(17)2923(19)24(30(22)27(31)34)1576816(28)1315h213222429H14H21H3t2224?m0s1
methyl2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzoate
methyl2((11aS)5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzoate
MFCD06766730
ZINC000008790464
ZINC000008790465
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.