Vitas-M small molecule compound
(4Z)-4-[2-(4-ethoxyphenyl)hydrazinylidene]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK019739
SMILES CCOc1ccc(cc1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]
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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 C27H22N6O5S MW 542.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N6O5S/c1-3-38-22-14-8-19(9-15-22)29-30-25-24(18-4-10-20(11-5-18)33(35)36)31-32(26(25)34)27-28-23(16-39-27)17-6-12-21(37-2)13-7-17/h4-16,29H,3H2,1-2H3/b30-25-InChIKey
FYDHCJGJHUGYQN-JVCXMKTPSA-NSynonyms
(4Z)4((4ETHOXYPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)PYRAZOL3ONE
(4Z)4(2(4ETHOXYPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
CCOC1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)(N+)(=O)(O)
CCOc1ccc(cc1)NN=C1C(=NN(C1=O)c1scc(n1)c1ccc(cc1)OC)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC27H22N6O5Sc13382214819(91522)29302524(1841020(11518)33(35)36)3132(26(25)34)272823(163927)1761221(372)13717h41629H3H212H3b3025
MFCD01246766
STK019739
ZINC000097940265
ZINC100529619
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