Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(2,5-dimethylbenzyl)sulfanyl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL098523
SMILES Cc1ccc(c(c1)CSc1nc2c3ccccc3oc2c(=O)n1Cc1ccc2c(c1)OCO2)C
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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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-16-7-8-17(2)19(11-16)14-34-27-28-24-20-5-3-4-6-21(20)33-25(24)26(30)29(27)13-18-9-10-22-23(12-18)32-15-31-22/h3-12H,13-15H2,1-2H3InChIKey
IQAFPLODGAJMON-UHFFFAOYSA-NSynonyms
1291854-13-11291854131
3(13benzodioxol5ylmethyl)2((25dimethylbenzyl)sulfanyl)(1)benzofuro(32d)pyrimidin4(3H)one
3(13benzodioxol5ylmethyl)2((25dimethylphenyl)methylsulfanyl)(1)benzofuro(32d)pyrimidin4one
CC1=CC(=C(C=C1)C)CSC2=NC3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=CC=CC=C63
InChI=1SC27H22N2O4Sc1167817(2)19(1116)143427282420534621(20)3325(24)26(30)29(27)13189102223(1218)32153122h312H1315H212H3
MFCD18789766
ZINC000067259796
ZINC67259796
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