Vitas-M small molecule compound
2-[(4-methoxybenzyl)sulfanyl]-3-[3-(propan-2-yloxy)propyl]quinazolin-4(3H)-one
Catalog ID
STL106547
SMILES COc1ccc(cc1)CSc1nc2ccccc2c(=O)n1CCCOC(C)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 C22H26N2O3S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O3S/c1-16(2)27-14-6-13-24-21(25)19-7-4-5-8-20(19)23-22(24)28-15-17-9-11-18(26-3)12-10-17/h4-5,7-12,16H,6,13-15H2,1-3H3InChIKey
ABKIRXWQFXRTFN-UHFFFAOYSA-NSynonyms
2((4methoxybenzyl)sulfanyl)3(3(propan2yloxy)propyl)quinazolin4(3H)one
2((4methoxyphenyl)methylsulfanyl)3(3propan2yloxypropyl)quinazolin4one
CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)OC
InChI=1SC22H26N2O3Sc116(2)27146132421(25)19745820(19)2322(24)28151791118(263)121017h4571216H61315H213H3
MFCD20737858
ZINC000045649515
ZINC45649515
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