Vitas-M small molecule compound
(5E)-2-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STL175480
SMILES COc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN2C(C1)CCC2
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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 C18H21N3O2S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O2S/c1-23-15-6-4-13(5-7-15)11-16-17(22)19-18(24-16)21-10-9-20-8-2-3-14(20)12-21/h4-7,11,14H,2-3,8-10,12H2,1H3/b16-11+InChIKey
OVMYBDWIJQBSBL-LFIBNONCSA-NSynonyms
938001-89-9(5E)2(346788ahexahydro1Hpyrrolo(12a)pyrazin2yl)5((4methoxyphenyl)methylidene)13thiazol4one
(5E)2(hexahydropyrrolo(12a)pyrazin2(1H)yl)5(4methoxybenzylidene)13thiazol4(5H)one
938001899
COC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN4CCCC4C3
COc1ccc(cc1)C=C1SC(=NC1=O)N1CCN2C(C1)CCC2
InChI=1SC18H21N3O2Sc123156413(5715)111617(22)1918(2416)211092082314(20)1221h471114H2381012H21H3b1611+
MFCD08555766
ZINC000020607849
ZINC000020607850
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