Vitas-M small molecule compound
4-(furan-2-ylmethyl)-1-thioxo-2,4-dihydro-1H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK856166
SMILES O=c1n(Cc2ccco2)c2n[nH]c(=S)n2c2c1C1(CCCCC1)Cc1c2cccc1
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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 C23H22N4O2S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O2S/c28-20-18-19(17-9-3-2-7-15(17)13-23(18)10-4-1-5-11-23)27-21(24-25-22(27)30)26(20)14-16-8-6-12-29-16/h2-3,6-9,12H,1,4-5,10-11,13-14H2,(H,25,30)InChIKey
QJBAWNDAKJYXJO-UHFFFAOYSA-NSynonyms
381717-06-2381717062
4(furan2ylmethyl)1thioxo24dihydro1Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C5=NNC(=S)N45)CC6=CC=CO6
InChI=1SC23H22N4O2Sc28201819(17932715(17)1323(18)104151123)2721(242522(27)30)26(20)141686122916h236912H14510111314H2(H2530)
MFCD09790399
O=c1n(Cc2ccco2)c2n(nH)c(=S)n2c2c1C1(CCCCC1)Cc1c2cccc1
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