Vitas-M small molecule compound
ethyl 4-{[11-(4-tert-butylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Catalog ID
STK546961
SMILES CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)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 C38H36N6O2 MW 608.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H36N6O2/c1-6-46-37(45)26-18-22-28(23-19-26)39-34-36-41-35-32(24(2)42-44(35)29-12-8-7-9-13-29)33(25-16-20-27(21-17-25)38(3,4)5)43(36)31-15-11-10-14-30(31)40-34/h7-23,33H,6H2,1-5H3,(H,39,40)InChIKey
FTNLFSJMWNQCMJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N4C2=NC5=C(C4C6=CC=C(C=C6)C(C)(C)C)C(=NN5C7=CC=CC=C7)C
ethyl4((11(4(tertbutyl)phenyl)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6yl)amino)benzoate
ethyl4((11(4tertbutylphenyl)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6yl)amino)benzoate
InChI=1SC38H36N6O2c164637(45)26182228(231926)393436413532(24(2)4244(35)29128791329)33(25162027(211725)38(34)5)43(36)311511101430(31)4034h72333H6H215H3(H3940)
MFCD03301585
ZINC000102446432
ZINC000102446437
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