Vitas-M small molecule compound
methyl [(4Z)-5-oxo-1-phenyl-4-(1-{[2-(thiophen-2-yl)ethyl]amino}ethylidene)-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK231981
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCCc1cccs1)/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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-14(21-11-10-16-9-6-12-27-16)19-17(13-18(24)26-2)22-23(20(19)25)15-7-4-3-5-8-15/h3-9,12,21H,10-11,13H2,1-2H3/b19-14-InChIKey
SZZPSCAOCLVBBA-RGEXLXHISA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCCC3=CC=CS3
COC(=O)CC1=NN(C(=O)C1=C(NCCc1cccs1)C)c1ccccc1
InChI=1SC20H21N3O3Sc114(2111101696122716)1917(1318(24)262)2223(20(19)25)157435815h391221H101113H212H3b1914
methyl((4Z)5oxo1phenyl4(1((2(thiophen2yl)ethyl)amino)ethylidene)45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)5OXO1PHENYL4(1(2THIOPHEN2YLETHYLAMINO)ETHYLIDENE)PYRAZOL3YL)ACETATE
METHYL2(5OXO1PHENYL4(((2(2THIENYL)ETHYL)AMINO)ETHYLIDENE)12DIAZOLIN3YL)ACETATE
MFCD07597921
ZINC000004736922
ZINC04736922
ZINC4736922
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