Vitas-M small molecule compound

methyl 4-{6-[(4-butylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate

Catalog ID
STK541575
SMILES CCCCc1ccc(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 C37H34N6O2 MW 594.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H34N6O2/c1-4-5-11-25-16-22-28(23-17-25)38-34-36-40-35-32(24(2)41-43(35)29-12-7-6-8-13-29)33(26-18-20-27(21-19-26)37(44)45-3)42(36)31-15-10-9-14-30(31)39-34/h6-10,12-23,33H,4-5,11H2,1-3H3,(H,38,39)
InChIKey
HERMYWZOLUOTGE-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N4C2=NC5=C(C4C6=CC=C(C=C6)C(=O)OC)C(=NN5C7=CC=CC=C7)C
InChI=1SC37H34N6O2c1451125162228(231725)383436403532(24(2)4143(35)29127681329)33(26182027(211926)37(44)453)42(36)31151091430(31)3934h610122333H4511H213H3(H3839)
methyl4(6((4butylphenyl)amino)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)benzoate
MFCD03296008
ZINC000001866151
ZINC000001866153

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Available files

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