Vitas-M small molecule compound

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

Catalog ID
STK232021
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\Nc1ccc(cc1)Cn1cncn1)/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 C23H22N6O3 MW 430.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O3/c1-16(26-18-10-8-17(9-11-18)13-28-15-24-14-25-28)22-20(12-21(30)32-2)27-29(23(22)31)19-6-4-3-5-7-19/h3-11,14-15,26H,12-13H2,1-2H3/b22-16-
InChIKey
YCXZFVXUWNNROZ-JWGURIENSA-N
Synonyms

(Z)methyl2(4(1((4((1H124triazol1yl)methyl)phenyl)amino)ethylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NC3=CC=C(C=C3)CN4C=NC=N4
COC(=O)CC1=NN(C(=O)C1=C(Nc1ccc(cc1)Cn1cncn1)C)c1ccccc1
InChI=1SC23H22N6O3c116(261810817(91118)13281524142528)2220(1221(30)322)2729(23(22)31)196435719h311141526H1213H212H3b2216
methyl((4Z)5oxo1phenyl4(1((4(1H124triazol1ylmethyl)phenyl)amino)ethylidene)45dihydro1Hpyrazol3yl)acetate
methyl2((4Z)5oxo1phenyl4(1(4(124triazol1ylmethyl)anilino)ethylidene)pyrazol3yl)acetate
METHYL2(5OXO1PHENYL4(((4(124TRIAZOLYLMETHYL)PHENYL)AMINO)ETHYLIDENE)12DIAZOLIN3YL)ACETATE
MFCD08086052
ZINC000009290927
ZINC09290927
ZINC9290927

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Available files

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