Vitas-M small molecule compound
(12bS)-2-(3,4-dichlorobenzyl)-7-(4-ethylphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL528870
SMILES CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccc(c(c1)Cl)Cl
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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 C30H27Cl2N3O2 MW 532.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27Cl2N3O2/c1-3-18-8-11-20(12-9-18)22-16-35-26(36)17-34(15-19-10-13-23(31)24(32)14-19)29(37)30(35,2)28-27(22)21-6-4-5-7-25(21)33-28/h4-14,22,33H,3,15-17H2,1-2H3/t22?,30-/m0/s1InChIKey
KFPRUBNCZWSGRR-YBJSGSKQSA-NSynonyms
956965-98-3(12bS)2(34dichlorobenzyl)7(4ethylphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(34dichlorobenzyl)7(4ethylphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4((34dichlorophenyl)methyl)9(4ethylphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402838
956965983
CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccc(c(c1)Cl)Cl
InChI=1SC30H27Cl2N3O2c131881120(12918)22163526(36)1734(1519101323(31)24(32)1419)29(37)30(352)2827(22)21645725(21)3328h4142233H31517H212H3t22?30m0s1
MFCD06494502
ZINC000070697011
ZINC000070697013
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