Vitas-M small molecule compound
methyl 4-{6-[(4-methoxyphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Catalog ID
STK543877
SMILES COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)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 C34H28N6O3 MW 568.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N6O3/c1-21-29-30(22-13-15-23(16-14-22)34(41)43-3)39-28-12-8-7-11-27(28)36-31(35-24-17-19-26(42-2)20-18-24)33(39)37-32(29)40(38-21)25-9-5-4-6-10-25/h4-20,30H,1-3H3,(H,35,36)InChIKey
NFVSPBVAQTVHSR-UHFFFAOYSA-NSynonyms
CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC=C(C=C5)OC)C6=CC=C(C=C6)C(=O)OC)C7=CC=CC=C7
InChI=1SC34H28N6O3c1212930(22131523(161422)34(41)433)392812871127(28)3631(3524171926(422)201824)33(39)3732(29)40(3821)2595461025h42030H13H3(H3536)
methyl4(6((4methoxyphenyl)amino)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)benzoate
MFCD03297806
ZINC000001739303
ZINC000001739307
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