Vitas-M small molecule compound
(5E)-2-[4-(3-methylphenyl)piperazin-1-yl]-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK731020
SMILES Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/S1
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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/c1-17-4-2-6-19(14-17)27-10-12-28(13-11-27)25-26-24(30)23(34-25)16-21-8-9-22(33-21)18-5-3-7-20(15-18)29(31)32/h2-9,14-16H,10-13H2,1H3/b23-16+InChIKey
KODGMYLLGUZELS-XQNSMLJCSA-NSynonyms
(5E)2(4(3methylphenyl)piperazin1yl)5((5(3nitrophenyl)furan2yl)methylidene)13thiazol4(5H)one
(5E)2(4(3METHYLPHENYL)PIPERAZIN1YL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)13THIAZOL4ONE
(E)5((5(3nitrophenyl)furan2yl)methylene)2(4(mtolyl)piperazin1yl)thiazol4(5H)one
CC1=CC(=CC=C1)N2CCN(CC2)C3=NC(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)(N+)(=O)(O))S3
Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))S1
InChI=1SC25H22N4O4Sc11742619(1417)27101228(131127)252624(30)23(3425)16218922(3321)1853720(1518)29(31)32h291416H1013H21H3b2316+
MFCD02237912
ZINC000008846760
ZINC08846760
ZINC8846760
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