Vitas-M small molecule compound

(8E)-2-amino-4-(1-methyl-1H-pyrazol-4-yl)-8-[(1-methyl-1H-pyrazol-4-yl)methylidene]-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

Catalog ID
STK956220
SMILES N#CC1=C(N)OC2=C(C1c1cnn(c1)C)CCC/C/2=C\c1cnn(c1)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 C19H20N6O MW 348.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O/c1-24-10-12(8-22-24)6-13-4-3-5-15-17(14-9-23-25(2)11-14)16(7-20)19(21)26-18(13)15/h6,8-11,17H,3-5,21H2,1-2H3/b13-6+
InChIKey
MYMGTGCTQDNXJC-AWNIVKPZSA-N
Synonyms
512811-53-9
(8E)2amino4(1methyl1Hpyrazol4yl)8((1methyl1Hpyrazol4yl)methylidene)5678tetrahydro4Hchromene3carbonitrile
(8E)2amino4(1methylpyrazol4yl)8((1methylpyrazol4yl)methylidene)4567tetrahydrochromene3carbonitrile
512811539
CN1C=C(C=N1)C=C2CCCC3=C2OC(=C(C3C4=CN(N=C4)C)C#N)N
InChI=1SC19H20N6Oc1241012(82224)6134351517(1492325(2)1114)16(720)19(21)2618(13)15h681117H3521H212H3b136+
MFCD03074809
N#CC1=C(N)OC2=C(C1c1cnn(c1)C)CCCC2=Cc1cnn(c1)C
ZINC000002749325
ZINC000002749327

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Available files

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