Vitas-M small molecule compound
(5Z)-2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-(2,4-dimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK795138
SMILES COc1cc(OC)ccc1/C=C/1\SC(=NC1=O)N1CCc2c(C1)cccc2
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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 C21H20N2O3S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3S/c1-25-17-8-7-15(18(12-17)26-2)11-19-20(24)22-21(27-19)23-10-9-14-5-3-4-6-16(14)13-23/h3-8,11-12H,9-10,13H2,1-2H3/b19-11-InChIKey
CCMQXMYXNOWKBX-ODLFYWEKSA-NSynonyms
632300-01-7(5Z)2(34DIHYDRO1HISOQUINOLIN2YL)5((24DIMETHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(34DIHYDROISOQUINOLIN2(1H)YL)5(24DIMETHOXYBENZYLIDENE)13THIAZOL4(5H)ONE
(Z)2(34dihydroisoquinolin2(1H)yl)5(24dimethoxybenzylidene)thiazol4(5H)one
632300017
COC1=CC(=C(C=C1)C=C2C(=O)N=C(S2)N3CCC4=CC=CC=C4C3)OC
COc1cc(OC)ccc1C=C1SC(=NC1=O)N1CCc2c(C1)cccc2
InChI=1SC21H20N2O3Sc125178715(18(1217)262)111920(24)2221(2719)2310914534616(14)1323h381112H91013H212H3b1911
MFCD03765546
ZINC000013513393
ZINC13513393
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