Vitas-M small molecule compound

(12bS)-7-(2-chlorophenyl)-2-[2-(1H-indol-3-yl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL529044
SMILES Clc1ccccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1c[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 C31H27ClN4O2 MW 523.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN4O2/c1-31-29-28(22-10-4-7-13-26(22)34-29)23(21-9-2-5-11-24(21)32)17-36(31)27(37)18-35(30(31)38)15-14-19-16-33-25-12-6-3-8-20(19)25/h2-13,16,23,33-34H,14-15,17-18H2,1H3/t23?,31-/m0/s1
InChIKey
IUHSGFVYXHEOJX-HPTWYVLESA-N
Synonyms
956812-77-4
(12bS)2(2(1Hindol3yl)ethyl)7(2chlorophenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(12bS)7(2chlorophenyl)2(2(1Hindol3yl)ethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))9(2chlorophenyl)4(2(1~(H)indol3yl)ethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402144
956812774
Clc1ccccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1c(nH)c2c1cccc2
InChI=1SC31H27ClN4O2c1312928(2210471326(22)3429)23(219251124(21)32)1736(31)27(37)1835(30(31)38)1514191633251263820(19)25h21316233334H14151718H21H3t23?31m0s1
MFCD06493006
ZINC000012874427
ZINC000012874436

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Available files

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