Vitas-M small molecule compound
ethyl 4-[(2Z)-2-{1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoate
Catalog ID
STK058413
SMILES CCOC(=O)c1ccc(cc1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Cl)C
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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 C22H18ClN5O3S MW 467.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O3S/c1-3-31-21(30)15-6-10-17(11-7-15)25-26-19-13(2)27-28(20(19)29)22-24-18(12-32-22)14-4-8-16(23)9-5-14/h4-12,25H,3H2,1-2H3/b26-19-InChIKey
LDNDEGJTQIJDKK-XHPQRKPJSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)Cl)C
CCOC(=O)c1ccc(cc1)NN=C1C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Cl)C
ETHYL4((2Z)2(1(4(4CHLOROPHENYL)13THIAZOL2YL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZOATE
ETHYL4((2Z)2(1(4(4CHLOROPHENYL)13THIAZOL2YL)3METHYL5OXOPYRAZOL4YLIDENE)HYDRAZINYL)BENZOATE
InChI=1SC22H18ClN5O3Sc133121(30)1561017(11715)25261913(2)2728(20(19)29)222418(123222)144816(23)9514h41225H3H212H3b2619
MFCD01419044
STK058413
ZINC000101453081
ZINC13896308
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