Vitas-M small molecule compound

ethyl 2-chloro-5-({(E)-[3-methyl-1-(naphthalen-1-yl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate

Catalog ID
STL295530
SMILES CCOC(=O)c1cc(N/C=C/2\C(=NN(C2=O)c2cccc3c2cccc3)C)ccc1Cl

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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 C24H20ClN3O3 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O3/c1-3-31-24(30)19-13-17(11-12-21(19)25)26-14-20-15(2)27-28(23(20)29)22-10-6-8-16-7-4-5-9-18(16)22/h4-14,26H,3H2,1-2H3/b20-14+
InChIKey
ZBTPHTNWEZSKFG-XSFVSMFZSA-N
Synonyms

CCOC(=O)C1=C(C=CC(=C1)NC=C2C(=NN(C2=O)C3=CC=CC4=CC=CC=C43)C)Cl
CCOC(=O)c1cc(NC=C2C(=NN(C2=O)c2cccc3c2cccc3)C)ccc1Cl
ethyl2chloro5(((E)(3methyl1(naphthalen1yl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
ETHYL2CHLORO5(((E)(3METHYL1NAPHTHALEN1YL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
InChI=1SC24H20ClN3O3c133124(30)191317(111221(19)25)26142015(2)2728(23(20)29)22106816745918(16)22h41426H3H212H3b2014+
MFCD28033014
ZINC000101113838
ZINC08430622
ZINC101113838

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Available files

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