Vitas-M small molecule compound
(4E)-2-(4-bromo-3-methylphenyl)-5-methyl-4-{[(3-methylphenyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295759
SMILES Cc1cccc(c1)N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)C)Br)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 C19H18BrN3O MW 384.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3O/c1-12-5-4-6-15(9-12)21-11-17-14(3)22-23(19(17)24)16-7-8-18(20)13(2)10-16/h4-11,21H,1-3H3/b17-11+InChIKey
KHOGRNRQHWYCML-GZTJUZNOSA-NSynonyms
(4E)2(4bromo3methylphenyl)5methyl4(((3methylphenyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(4bromo3methylphenyl)5methyl4((3methylanilino)methylidene)pyrazol3one
CC1=CC(=CC=C1)NC=C2C(=NN(C2=O)C3=CC(=C(C=C3)Br)C)C
Cc1cccc(c1)NC=C1C(=NN(C1=O)c1ccc(c(c1)C)Br)C
InChI=1SC19H18BrN3Oc11254615(912)21111714(3)2223(19(17)24)167818(20)13(2)1016h41121H13H3b1711+
MFCD28033125
ZINC000101123610
ZINC06815706
ZINC101123610
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