Vitas-M small molecule compound
(5Z)-2-(4-benzylpiperidin-1-yl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK810677
SMILES O=C1N=C(S/C/1=C\c1ccc(o1)c1ccccc1[N+](=O)[O-])N1CCC(CC1)Cc1ccccc1
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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 C26H23N3O4S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4S/c30-25-24(17-20-10-11-23(33-20)21-8-4-5-9-22(21)29(31)32)34-26(27-25)28-14-12-19(13-15-28)16-18-6-2-1-3-7-18/h1-11,17,19H,12-16H2/b24-17-InChIKey
WFYDSCLZAFGFDW-ULJHMMPZSA-NSynonyms
(5Z)2(4benzylpiperidin1yl)5((5(2nitrophenyl)furan2yl)methylidene)13thiazol4(5H)one
(5Z)2(4BENZYLPIPERIDIN1YL)5((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)13THIAZOL4ONE
C1CN(CCC1CC2=CC=CC=C2)C3=NC(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))S3
InChI=1SC26H23N3O4Sc302524(1720101123(3320)21845922(21)29(31)32)3426(2725)28141219(131528)16186213718h1111719H1216H2b2417
MFCD03952287
O=C1N=C(SC1=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))N1CCC(CC1)Cc1ccccc1
ZINC000002811742
ZINC02811742
ZINC2811742
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