Vitas-M small molecule compound

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

Catalog ID
STK234768
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCC1CCCO1)/C)c1ccc(cc1)OC

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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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-13(21-12-16-5-4-10-28-16)19-17(11-18(24)27-3)22-23(20(19)25)14-6-8-15(26-2)9-7-14/h6-9,16,21H,4-5,10-12H2,1-3H3/b19-13-
InChIKey
AGJCTFUIJBWXKW-UYRXBGFRSA-N
Synonyms

CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)OC)CC(=O)OC)NCC3CCCO3
InChI=1SC20H25N3O5c113(21121654102816)1917(1118(24)273)2223(20(19)25)146815(262)9714h691621H451012H213H3b1913
methyl((4Z)1(4methoxyphenyl)5oxo4(1((tetrahydrofuran2ylmethyl)amino)ethylidene)45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(4METHOXYPHENYL)5OXO4(1(OXOLAN2YLMETHYLAMINO)ETHYLIDENE)PYRAZOL3YL)ACETATE
METHYL2(1(4METHOXYPHENYL)5OXO4(((OXOLAN2YLMETHYL)AMINO)ETHYLIDENE)12DIAZOLIN3YL)ACETATE
MFCD07597769
ZINC000004999650
ZINC000004999651

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Available files

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