Vitas-M small molecule compound
(5E)-2-(4-benzylpiperazin-1-yl)-5-(3-hydroxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STL436468
SMILES Oc1cccc(c1)/C=C\1/SC(=NC1=O)N1CCN(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 C21H21N3O2S MW 379.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S/c25-18-8-4-7-17(13-18)14-19-20(26)22-21(27-19)24-11-9-23(10-12-24)15-16-5-2-1-3-6-16/h1-8,13-14,25H,9-12,15H2/b19-14+InChIKey
GOMJVUOOUNURJJ-XMHGGMMESA-NSynonyms
(5E)2(4benzylpiperazin1yl)5((3hydroxyphenyl)methylidene)13thiazol4one
(5E)2(4benzylpiperazin1yl)5(3hydroxybenzylidene)13thiazol4(5H)one
C1CN(CCN1CC2=CC=CC=C2)C3=NC(=O)C(=CC4=CC(=CC=C4)O)S3
InChI=1SC21H21N3O2Sc251884717(1318)141920(26)2221(2719)2411923(101224)15165213616h18131425H91215H2b1914+
MFCD30711977
Oc1cccc(c1)C=C1SC(=NC1=O)N1CCN(CC1)Cc1ccccc1
ZINC000033339036
ZINC33339036
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