Vitas-M small molecule compound
4-{6-[(4-butylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}-2-methoxyphenol
Catalog ID
STK550596
SMILES CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)OC)O)c(nn1c1ccccc1)C
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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 C36H34N6O2 MW 582.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H34N6O2/c1-4-5-11-24-16-19-26(20-17-24)37-34-36-39-35-32(23(2)40-42(35)27-12-7-6-8-13-27)33(25-18-21-30(43)31(22-25)44-3)41(36)29-15-10-9-14-28(29)38-34/h6-10,12-22,33,43H,4-5,11H2,1-3H3,(H,37,38)InChIKey
UYXIMJHWQBCDSN-UHFFFAOYSA-NSynonyms
4(6((4butylphenyl)amino)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)2methoxyphenol
CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N4C2=NC5=C(C4C6=CC(=C(C=C6)O)OC)C(=NN5C7=CC=CC=C7)C
InChI=1SC36H34N6O2c1451124161926(201724)373436393532(23(2)4042(35)27127681327)33(25182130(43)31(2225)443)41(36)29151091428(29)3834h61012223343H4511H213H3(H3738)
MFCD03685567
ZINC000001874564
ZINC000001874565
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