Vitas-M small molecule compound

11-(4-tert-butylphenyl)-N-(4-chloro-3-nitrophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine

Catalog ID
STK546097
SMILES Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2ccc(c(c2)[N+](=O)[O-])Cl)nc2c1cccc2)c1ccccc1

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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 C35H30ClN7O2 MW 616.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30ClN7O2/c1-21-30-31(22-14-16-23(17-15-22)35(2,3)4)41-28-13-9-8-12-27(28)38-32(37-24-18-19-26(36)29(20-24)43(44)45)34(41)39-33(30)42(40-21)25-10-6-5-7-11-25/h5-20,31H,1-4H3,(H,37,38)
InChIKey
BQYOEARIDZSTLY-UHFFFAOYSA-N
Synonyms

11(4(tertbutyl)phenyl)N(4chloro3nitrophenyl)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6amine
11(4tertbutylphenyl)N(4chloro3nitrophenyl)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6amine
CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC(=C(C=C5)Cl)(N+)(=O)(O))C6=CC=C(C=C6)C(C)(C)C)C7=CC=CC=C7
Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2ccc(c(c2)(N+)(=O)(O))Cl)nc2c1cccc2)c1ccccc1
InChI=1SC35H30ClN7O2c1213031(22141623(171522)35(23)4)412813981227(28)3832(3724181926(36)29(2024)43(44)45)34(41)3933(30)42(4021)25106571125h52031H14H3(H3738)
MFCD03290928
ZINC000102443551
ZINC000102443556

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Available files

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