Vitas-M small molecule compound
(5Z)-5-(4-ethylbenzylidene)-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Catalog ID
STL052282
SMILES CCc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCN(CC1)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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-2-16-3-5-17(6-4-16)15-20-21(27)23-22(30-20)25-13-11-24(12-14-25)18-7-9-19(10-8-18)26(28)29/h3-10,15H,2,11-14H2,1H3/b20-15-InChIKey
DTGYDOZUVZVMJX-HKWRFOASSA-NSynonyms
714934-22-2(5Z)5((4ETHYLPHENYL)METHYLIDENE)2(4(4NITROPHENYL)PIPERAZIN1YL)13THIAZOL4ONE
(5Z)5(4ethylbenzylidene)2(4(4nitrophenyl)piperazin1yl)13thiazol4(5H)one
(Z)5(4ethylbenzylidene)2(4(4nitrophenyl)piperazin1yl)thiazol4(5H)one
714934222
CCC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=C(C=C4)(N+)(=O)(O)
CCc1ccc(cc1)C=C1SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H22N4O3Sc12163517(6416)152021(27)2322(3020)25131124(121425)187919(10818)26(28)29h31015H21114H21H3b2015
MFCD05698991
ZINC000009293241
ZINC09293241
ZINC9293241
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