Vitas-M small molecule compound
methyl {(4E)-4-[4-(dimethylamino)benzylidene]-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl}acetate
Catalog ID
STK150024
SMILES COC(=O)CC1=NN(C(=O)/C/1=C/c1ccc(cc1)N(C)C)c1ccccc1
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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 C21H21N3O3 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3/c1-23(2)16-11-9-15(10-12-16)13-18-19(14-20(25)27-3)22-24(21(18)26)17-7-5-4-6-8-17/h4-13H,14H2,1-3H3/b18-13+InChIKey
HTCZTPFENUHFEO-QGOAFFKASA-NSynonyms
CN(C)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OC
COC(=O)CC1=NN(C(=O)C1=Cc1ccc(cc1)N(C)C)c1ccccc1
InChI=1SC21H21N3O3c123(2)1611915(101216)131819(1420(25)273)2224(21(18)26)177546817h413H14H213H3b1813+
METHYL((4E)4(4(DIMETHYLAMINO)BENZYLIDENE)5OXO1PHENYL45DIHYDRO1HPYRAZOL3YL)ACETATE
methyl2((4E)4((4(dimethylamino)phenyl)methylidene)5oxo1phenylpyrazol3yl)acetate
METHYL2((4E)4((4DIMETHYLAMINOPHENYL)METHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4((4(DIMETHYLAMINO)PHENYL)METHYLENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD04222014
ZINC000004687503
ZINC04687503
ZINC4687503
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