Vitas-M small molecule compound
(12aS)-2-(3,4-dichlorobenzyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL540297
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)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 C29H25Cl2N3O3 MW 534.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25Cl2N3O3/c1-2-37-25-10-6-4-8-19(25)28-27-20(18-7-3-5-9-23(18)32-27)14-24-29(36)33(16-26(35)34(24)28)15-17-11-12-21(30)22(31)13-17/h3-13,24,28,32H,2,14-16H2,1H3/t24-,28?/m0/s1InChIKey
QNRYDMZUQPFCNR-ZZDYIDRTSA-NSynonyms
957000-74-7(12aS)2(34dichlorobenzyl)6(2ethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(34dichlorobenzyl)6(2ethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((34dichlorophenyl)methyl)2(2ethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400230
957000747
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccc(c(c1)Cl)Cl
InChI=1SC29H25Cl2N3O3c1237251064819(25)282720(18735923(18)3227)142429(36)33(1626(35)34(24)28)1517111221(30)22(31)1317h313242832H21416H21H3t2428?m0s1
MFCD05671072
ZINC000002109048
ZINC000002109050
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