Vitas-M small molecule compound

(12bS)-2-[3-(diethylamino)propyl]-7-(3-methoxy-4-propoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL528920
SMILES CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCN(CC)CC

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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 C32H42N4O4 MW 546.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H42N4O4/c1-6-18-40-26-15-14-22(19-27(26)39-5)24-20-36-28(37)21-35(17-11-16-34(7-2)8-3)31(38)32(36,4)30-29(24)23-12-9-10-13-25(23)33-30/h9-10,12-15,19,24,33H,6-8,11,16-18,20-21H2,1-5H3/t24?,32-/m0/s1
InChIKey
PKQOAXLKFOJMFA-TWAVRPEISA-N
Synonyms
956953-67-6
(12bS)2(3(diethylamino)propyl)7(3methoxy4propoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(3(diethylamino)propyl)7(3methoxy4propoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(3(diethylamino)propyl)9(3methoxy4propoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402305
956953676
CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCN(CC)CC
InChI=1SC32H42N4O4c16184026151422(1927(26)395)24203628(37)2135(17111634(72)83)31(38)32(364)3029(24)23129101325(23)3330h9101215192433H681116182021H215H3t24?32m0s1
MFCD06493349
ZINC000070692199
ZINC000070692200

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Available files

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