Vitas-M small molecule compound
(12aS)-2-(2-chlorobenzyl)-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL457896
SMILES O=C1N(CC(=O)N2[C@H]1Cc1c(C2c2ccccc2)[nH]c2c1cccc2)Cc1ccccc1Cl
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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 C27H22ClN3O2 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O2/c28-21-12-6-4-10-18(21)15-30-16-24(32)31-23(27(30)33)14-20-19-11-5-7-13-22(19)29-25(20)26(31)17-8-2-1-3-9-17/h1-13,23,26,29H,14-16H2/t23-,26?/m0/s1InChIKey
VQVQAAAURYTMPK-ZZHFZYNASA-NSynonyms
956993-57-0(12aS)2(2chlorobenzyl)6phenyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(2chlorobenzyl)6phenyl671212atetrahydro3Hpyrazino(12b)$bcarboline14quinone
(S)2(2chlorobenzyl)6phenyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
956993570
C1C2C(=O)N(CC(=O)N2C(C3=C1C4=CC=CC=C4N3)C5=CC=CC=C5)CC6=CC=CC=C6Cl
InChI=1SC27H22ClN3O2c282112641018(21)15301624(32)3123(27(30)33)14201911571322(19)2925(20)26(31)178213917h113232629H1416H2t2326?m0s1
MFCD03266559
O=C1N(CC(=O)N2(C@H)1Cc1c(C2c2ccccc2)(nH)c2c1cccc2)Cc1ccccc1Cl
ZINC000002092089
ZINC000002092091
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