Vitas-M small molecule compound
(3Z,5E)-3,5-bis(4-methoxybenzylidene)tetrahydro-4H-thiopyran-4-one
Catalog ID
STL333156
SMILES COc1ccc(cc1)/C=C/1\CSC/C(=C/c2ccc(cc2)OC)/C1=O
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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 C21H20O3S MW 352.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O3S/c1-23-19-7-3-15(4-8-19)11-17-13-25-14-18(21(17)22)12-16-5-9-20(24-2)10-6-16/h3-12H,13-14H2,1-2H3/b17-11-,18-12+InChIKey
JNRJHGLBAWJZGM-MJZABRMRSA-NSynonyms
(3E5Z)35BIS((4METHOXYPHENYL)METHYLIDENE)THIAN4ONE
(3Z5E)35bis(4methoxybenzylidene)dihydro2Hthiopyran4(3H)one
(3Z5E)35bis(4methoxybenzylidene)tetrahydro4Hthiopyran4one
35BIS(4METHOXYBENZYLIDENE)TETRAHYDRO4HTHIOPYRAN4ONE
COC1=CC=C(C=C1)C=C2CSCC(=CC3=CC=C(C=C3)OC)C2=O
COc1ccc(cc1)C=C1CSCC(=Cc2ccc(cc2)OC)C1=O
InChI=1SC21H20O3Sc123197315(4819)111713251418(21(17)22)12165920(242)10616h312H1314H212H3b17111812+
MFCD03270492
ZINC000000971470
ZINC00971470
ZINC05151273
ZINC971470
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