Vitas-M small molecule compound
3-{[(4E)-1-(4-methylphenyl)-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidene]amino}benzoic acid
Catalog ID
STL047866
SMILES Cc1ccc(cc1)n1ncc2c1[nH]cn/c/2=N/c1cccc(c1)C(=O)O
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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 C19H15N5O2 MW 345.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O2/c1-12-5-7-15(8-6-12)24-18-16(10-22-24)17(20-11-21-18)23-14-4-2-3-13(9-14)19(25)26/h2-11H,1H3,(H,25,26)(H,20,21,23)InChIKey
CNZRMHVYEAFJRB-UHFFFAOYSA-NSynonyms
371129-33-83(((4E)1(4methylphenyl)17dihydro4Hpyrazolo(34d)pyrimidin4ylidene)amino)benzoicacid
3((1(4METHYLPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)AMINO)BENZOICACID
3(1PTOLYL1HPYRAZOLO(34D)PYRIMIDIN4YLAMINO)BENZOICACID
371129338
CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=CC(=C4)C(=O)O
Cc1ccc(cc1)n1ncc2c1(nH)cnc2=Nc1cccc(c1)C(=O)O
InChI=1SC19H15N5O2c1125715(8612)241816(102224)17(20112118)231442313(914)19(25)26h211H1H3(H2526)(H202123)
MFCD03794165
ZINC000001777383
ZINC1777383
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