Vitas-M small molecule compound

(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(1'-ethyl-3',5'-dimethyl-1'H,2H-3,4'-bipyrazol-5-yl)methanone

Catalog ID
STL473079
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1n[nH]c(c1)c1c(C)nn(c1C)CC

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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 C22H27N5O3 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O3/c1-6-27-14(3)21(13(2)25-27)17-11-18(24-23-17)22(28)26-8-7-15-9-19(29-4)20(30-5)10-16(15)12-26/h9-11H,6-8,12H2,1-5H3,(H,23,24)
InChIKey
SQVXCWHAGBNIOM-UHFFFAOYSA-N
Synonyms
1491130-67-6
(67dimethoxy34dihydro1Hisoquinolin2yl)(3(1ethyl35dimethylpyrazol4yl)1Hpyrazol5yl)methanone
(67dimethoxy34dihydroisoquinolin2(1H)yl)(1ethyl35dimethyl1H1H(34bipyrazol)5yl)methanone
(67dimethoxy34dihydroisoquinolin2(1H)yl)(1ethyl35dimethyl1H2H34bipyrazol5yl)methanone
1491130676
CCN1C(=C(C(=N1)C)C2=NNC(=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C
COc1cc2CCN(Cc2cc1OC)C(=O)c1(nH)nc(c1)c1c(C)nn(c1C)CC
COc1cc2CCN(Cc2cc1OC)C(=O)c1n(nH)c(c1)c1c(C)nn(c1C)CC
InChI=1SC22H27N5O3c162714(3)21(13(2)2527)171118(242317)22(28)268715919(294)20(305)1016(15)1226h911H6812H215H3(H2324)
MFCD27962490
ZINC000085878457
ZINC85878457

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Available files

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