Vitas-M small molecule compound

methyl [(4Z)-1-(4-fluorophenyl)-5-oxo-4-{1-[(thiophen-2-ylmethyl)amino]ethylidene}-4,5-dihydro-1H-pyrazol-3-yl]acetate

Catalog ID
STK231969
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCc1cccs1)/C)c1ccc(cc1)F

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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 C19H18FN3O3S MW 387.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18FN3O3S/c1-12(21-11-15-4-3-9-27-15)18-16(10-17(24)26-2)22-23(19(18)25)14-7-5-13(20)6-8-14/h3-9,21H,10-11H2,1-2H3/b18-12-
InChIKey
PLDMBTBMLUHOOA-PDGQHHTCSA-N
Synonyms

CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)F)CC(=O)OC)NCC3=CC=CS3
COC(=O)CC1=NN(C(=O)C1=C(NCc1cccs1)C)c1ccc(cc1)F
InChI=1SC19H18FN3O3Sc112(2111154392715)1816(1017(24)262)2223(19(18)25)147513(20)6814h3921H1011H212H3b1812
methyl((4Z)1(4fluorophenyl)5oxo4(1((thiophen2ylmethyl)amino)ethylidene)45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(4FLUOROPHENYL)5OXO4(1(THIOPHEN2YLMETHYLAMINO)ETHYLIDENE)PYRAZOL3YL)ACETATE
METHYL2(1(4FLUOROPHENYL)5OXO4(((2THIENYLMETHYL)AMINO)ETHYLIDENE)12DIAZOLIN3YL)ACETATE
MFCD07597762
ZINC000004736909
ZINC04736909
ZINC4736909

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Available files

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