Vitas-M small molecule compound
(12aR)-2-[2-(4-methoxyphenyl)ethyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL527984
SMILES COc1ccc(cc1)CCN1CC(=O)N2[C@@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2
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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 C32H33N3O3 MW 507.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N3O3/c1-20(2)22-10-12-23(13-11-22)31-30-26(25-6-4-5-7-27(25)33-30)18-28-32(37)34(19-29(36)35(28)31)17-16-21-8-14-24(38-3)15-9-21/h4-15,20,28,31,33H,16-19H2,1-3H3/t28-,31?/m1/s1InChIKey
IAVPZTPQUKDLKR-ZZTVPSNHSA-NSynonyms
(12aR)2(2(4methoxyphenyl)ethyl)6(4(propan2yl)phenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4isopropylphenyl)2(4methoxyphenethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(R))6(2(4methoxyphenyl)ethyl)2(4propan2ylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639350
COc1ccc(cc1)CCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)C(C)C)(nH)c2c1cccc2
InChI=1SC32H33N3O3c120(2)22101223(131122)313026(25645727(25)3330)182832(37)34(1929(36)35(28)31)17162181424(383)15921h41520283133H1619H213H3t2831?m1s1
MFCD03661990
ZINC000016042807
ZINC000016042808
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