Vitas-M small molecule compound
(11bS)-6-(3-ethoxy-4-propoxyphenyl)-2-(2-fluorophenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Catalog ID
STL529494
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)N(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)c1ccccc1F
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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 C31H30FN3O4 MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN3O4/c1-4-16-39-25-15-14-19(17-26(25)38-5-2)21-18-34-30(37)35(24-13-9-7-11-22(24)32)29(36)31(34,3)28-27(21)20-10-6-8-12-23(20)33-28/h6-15,17,21,33H,4-5,16,18H2,1-3H3/t21?,31-/m0/s1InChIKey
LCNNOWQGHXMVQV-LAUUFCHVSA-NSynonyms
956992-36-2(11bS)6(3ethoxy4propoxyphenyl)2(2fluorophenyl)11bmethyl561111btetrahydro1Himidazo(1512)pyrido(34b)indole13(2H)dione
(2~(S))8(3ethoxy4propoxyphenyl)4(2fluorophenyl)2methyl4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraene35dione
16402530
956992362
CCCOc1ccc(cc1OCC)C1CN2C(=O)N(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)c1ccccc1F
InChI=1SC31H30FN3O4c14163925151419(1726(25)3852)21183430(37)35(2413971122(24)32)29(36)31(343)2827(21)2010681223(20)3328h615172133H451618H213H3t21?31m0s1
MFCD06493864
ZINC000008788815
ZINC000008788817
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