Vitas-M small molecule compound
2-[(2,5-dimethylbenzyl)sulfanyl]-3-(3-ethoxypropyl)quinazolin-4(3H)-one
Catalog ID
STL106573
SMILES CCOCCCn1c(SCc2cc(C)ccc2C)nc2c(c1=O)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 C22H26N2O2S MW 382.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O2S/c1-4-26-13-7-12-24-21(25)19-8-5-6-9-20(19)23-22(24)27-15-18-14-16(2)10-11-17(18)3/h5-6,8-11,14H,4,7,12-13,15H2,1-3H3InChIKey
UPAPDEPPZQSTLK-UHFFFAOYSA-NSynonyms
2((25dimethylbenzyl)sulfanyl)3(3ethoxypropyl)quinazolin4(3H)one
2((25dimethylphenyl)methylsulfanyl)3(3ethoxypropyl)quinazolin4one
CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)C)C
InChI=1SC22H26N2O2Sc1426137122421(25)19856920(19)2322(24)2715181416(2)101117(18)3h5681114H47121315H213H3
MFCD20737879
ZINC000067259154
ZINC67259154
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