Vitas-M small molecule compound

(12aS)-2-cyclohexyl-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL541568
SMILES Cc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1

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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 C27H29N3O2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2/c1-17-11-13-18(14-12-17)26-25-21(20-9-5-6-10-22(20)28-25)15-23-27(32)29(16-24(31)30(23)26)19-7-3-2-4-8-19/h5-6,9-14,19,23,26,28H,2-4,7-8,15-16H2,1H3/t23-,26?/m0/s1
InChIKey
FQSIPBLHTALEJB-ZZHFZYNASA-N
Synonyms
956147-87-8
(12aS)2cyclohexyl6(4methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2cyclohexyl6(ptolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6cyclohexyl2(4methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399978
956147878
Cc1ccc(cc1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)C1CCCCC1
InChI=1SC27H29N3O2c117111318(141217)262521(209561022(20)2825)152327(32)29(1624(31)30(23)26)197324819h5691419232628H24781516H21H3t2326?m0s1
MFCD04146859
ZINC000002107762
ZINC000002107764

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Available files

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