Vitas-M small molecule compound

(12bS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-7-(4-ethylphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL529181
SMILES CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1ccc(c(c1)OC)OC

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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 C33H35N3O4 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O4/c1-5-21-10-13-23(14-11-21)25-19-36-29(37)20-35(17-16-22-12-15-27(39-3)28(18-22)40-4)32(38)33(36,2)31-30(25)24-8-6-7-9-26(24)34-31/h6-15,18,25,34H,5,16-17,19-20H2,1-4H3/t25?,33-/m0/s1
InChIKey
ZXTSEEVLQSXQIO-ZEWJHAJUSA-N
Synonyms
956953-46-1
(12bS)2(2(34dimethoxyphenyl)ethyl)7(4ethylphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(34dimethoxyphenethyl)7(4ethylphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(2(34dimethoxyphenyl)ethyl)9(4ethylphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402214
956953461
CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1ccc(c(c1)OC)OC
InChI=1SC33H35N3O4c1521101323(141121)25193629(37)2035(171622121527(393)28(1822)404)32(38)33(362)3130(25)24867926(24)3431h615182534H516171920H214H3t25?33m0s1
MFCD06493168
ZINC000070692158
ZINC000070692159

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Available files

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