Vitas-M small molecule compound
3-(4-chlorobenzyl)-6,7-diethoxy-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STL144634
SMILES CCOc1cc2c(cc1OCC)[nH]c(=S)n(c2=O)Cc1ccc(cc1)Cl
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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 C19H19ClN2O3S MW 390.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3S/c1-3-24-16-9-14-15(10-17(16)25-4-2)21-19(26)22(18(14)23)11-12-5-7-13(20)8-6-12/h5-10H,3-4,11H2,1-2H3,(H,21,26)InChIKey
WJDMYSLVPYTZOP-UHFFFAOYSA-NSynonyms
689769-67-33((4CHLOROPHENYL)METHYL)67DIETHOXY2SULFANYLIDENE1HQUINAZOLIN4ONE
3(4chlorobenzyl)67diethoxy2thioxo23dihydroquinazolin4(1H)one
689769673
CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)Cl)OCC
CCOc1cc2c(cc1OCC)(nH)c(=S)n(c2=O)Cc1ccc(cc1)Cl
InChI=1SC19H19ClN2O3Sc13241691415(1017(16)2542)2119(26)22(18(14)23)11125713(20)8612h510H3411H212H3(H2126)
MFCD15089581
ZINC000002976549
ZINC2976549
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