Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylbenzyl)sulfanyl]quinazolin-4(3H)-one
Catalog ID
STL106771
SMILES Cc1ccc(cc1C)CSc1nc2ccccc2c(=O)n1Cc1ccc2c(c1)OCO2
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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 C25H22N2O3S MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O3S/c1-16-7-8-19(11-17(16)2)14-31-25-26-21-6-4-3-5-20(21)24(28)27(25)13-18-9-10-22-23(12-18)30-15-29-22/h3-12H,13-15H2,1-2H3InChIKey
GCBQXXLKNHTKIT-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2((34dimethylbenzyl)sulfanyl)quinazolin4(3H)one
3(13benzodioxol5ylmethyl)2((34dimethylphenyl)methylsulfanyl)quinazolin4one
CC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)C
InChI=1SC25H22N2O3Sc1167819(1117(16)2)1431252621643520(21)24(28)27(25)13189102223(1218)30152922h312H1315H212H3
MFCD20737995
ZINC000067259393
ZINC67259393
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