Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK804969
SMILES COc1ccc(cc1)n1c(=O)c2c(n3c1nnc3S)c1ccccc1CC12CCCCC1
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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 C25H24N4O2S MW 444.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2S/c1-31-18-11-9-17(10-12-18)28-22(30)20-21(29-23(28)26-27-24(29)32)19-8-4-3-7-16(19)15-25(20)13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,27,32)InChIKey
CPSZXFUEEIQRNB-UHFFFAOYSA-NSynonyms
5936-43-61mercapto4(4methoxyphenyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4(4methoxyphenyl)1sulfanyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4(4METHOXYPHENYL)1THIOXO24DIHYDRO1HSPIRO(BENZO(H)(124)TRIAZOLO(43A)QUINAZOLINE61CYCLOHEXAN)5(7H)ONE
5936436
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NNC6=S
InChI=1SC25H24N4O2Sc1311811917(101218)2822(30)2021(2923(28)262724(29)32)19843716(19)1525(20)135261425h34712H2561315H21H3(H2732)
MFCD01876687
ZINC000002271996
ZINC2271996
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