Vitas-M small molecule compound
(4E)-4-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK667257
SMILES CC1=NN(C(=O)/C/1=C/c1ccc(o1)c1cccc(c1Cl)Cl)c1nnn[nH]1
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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 C16H10Cl2N6O2 MW 389.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Cl2N6O2/c1-8-11(15(25)24(21-8)16-19-22-23-20-16)7-9-5-6-13(26-9)10-3-2-4-12(17)14(10)18/h2-7H,1H3,(H,19,20,22,23)/b11-7+InChIKey
CPTKRDAXBDAYQM-YRNVUSSQSA-NSynonyms
(4E)4((5(23dichlorophenyl)furan2yl)methylidene)5methyl2(1Htetrazol5yl)24dihydro3Hpyrazol3one
(4E)4((5(23dichlorophenyl)furan2yl)methylidene)5methyl2(2Htetrazol5yl)pyrazol3one
CC1=NN(C(=O)C1=Cc1ccc(o1)c1cccc(c1Cl)Cl)c1nnn(nH)1
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=C(C(=CC=C3)Cl)Cl)C4=NNN=N4
InChI=1SC16H10Cl2N6O2c1811(15(25)24(218)161922232016)795613(269)1032412(17)14(10)18h27H1H3(H19202223)b117+
MFCD18169421
ZINC000102570567
ZINC102570567
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