Vitas-M small molecule compound

methyl {(4Z)-4-[1-(tert-butylamino)ethylidene]-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl}acetate

Catalog ID
STK231950
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NC(C)(C)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 C18H23N3O3 MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3/c1-12(19-18(2,3)4)16-14(11-15(22)24-5)20-21(17(16)23)13-9-7-6-8-10-13/h6-10,19H,11H2,1-5H3/b16-12-
InChIKey
MNMGYUNCINCCNK-VBKFSLOCSA-N
Synonyms

CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NC(C)(C)C
COC(=O)CC1=NN(C(=O)C1=C(NC(C)(C)C)C)c1ccccc1
InChI=1SC18H23N3O3c112(1918(23)4)1614(1115(22)245)2021(17(16)23)1397681013h61019H11H215H3b1612
methyl((4Z)4(1(tertbutylamino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1(TERTBUTYLAMINO)ETHYLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
METHYL2(4(((TERTBUTYL)AMINO)ETHYLIDENE)5OXO1PHENYL12DIAZOLIN3YL)ACETATE
MFCD07792724
ZINC000004736892
ZINC4736892

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Available files

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