Vitas-M small molecule compound
(12bS)-7-(2-ethoxy-3-methoxyphenyl)-2-[3-(1H-imidazol-1-yl)propyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529328
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCn1cncc1
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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 C30H33N5O4 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O4/c1-4-39-27-20(10-7-12-24(27)38-3)22-17-35-25(36)18-34(15-8-14-33-16-13-31-19-33)29(37)30(35,2)28-26(22)21-9-5-6-11-23(21)32-28/h5-7,9-13,16,19,22,32H,4,8,14-15,17-18H2,1-3H3/t22?,30-/m0/s1InChIKey
NPFCNMQOMXJFNL-YBJSGSKQSA-NSynonyms
957030-17-0(12bS)2(3(1Himidazol1yl)propyl)7(2ethoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(12bS)7(2ethoxy3methoxyphenyl)2(3(1Himidazol1yl)propyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))9(2ethoxy3methoxyphenyl)4(3imidazol1ylpropyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402183
957030170
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCn1cncc1
InChI=1SC30H33N5O4c14392720(1071224(27)383)22173525(36)1834(15814331613311933)29(37)30(352)2826(22)219561123(21)3228h5791316192232H4814151718H213H3t22?30m0s1
MFCD06493091
ZINC000008918549
ZINC000008918550
ZINC08918549
Check stock
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