Vitas-M small molecule compound
(5E)-2-[4-(2-methylphenyl)piperazin-1-yl]-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK731026
SMILES O=C1N=C(S/C/1=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1C
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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 C25H22N4O4S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O4S/c1-17-5-2-3-8-21(17)27-11-13-28(14-12-27)25-26-24(30)23(34-25)16-20-9-10-22(33-20)18-6-4-7-19(15-18)29(31)32/h2-10,15-16H,11-14H2,1H3/b23-16+InChIKey
XDMKXRLDQHDNSU-XQNSMLJCSA-NSynonyms
(5E)2(4(2methylphenyl)piperazin1yl)5((5(3nitrophenyl)furan2yl)methylidene)13thiazol4(5H)one
(5E)2(4(2METHYLPHENYL)PIPERAZIN1YL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)13THIAZOL4ONE
(E)5((5(3nitrophenyl)furan2yl)methylene)2(4(otolyl)piperazin1yl)thiazol4(5H)one
CC1=CC=CC=C1N2CCN(CC2)C3=NC(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)(N+)(=O)(O))S3
InChI=1SC25H22N4O4Sc117523821(17)27111328(141227)252624(30)23(3425)162091022(3320)1864719(1518)29(31)32h2101516H1114H21H3b2316+
MFCD02234088
O=C1N=C(SC1=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))N1CCN(CC1)c1ccccc1C
ZINC000008846763
ZINC08846763
ZINC8846763
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