Vitas-M small molecule compound
4-(4-methylphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK804977
SMILES Cc1ccc(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 C25H24N4OS MW 428.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4OS/c1-16-9-11-18(12-10-16)28-22(30)20-21(29-23(28)26-27-24(29)31)19-8-4-3-7-17(19)15-25(20)13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,27,31)InChIKey
UZTNKMPNYZICMT-UHFFFAOYSA-NSynonyms
337488-18-31mercapto4(ptolyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
337488183
4(4methylphenyl)1sulfanyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NNC6=S
InChI=1SC25H24N4OSc11691118(121016)2822(30)2021(2923(28)262724(29)31)19843717(19)1525(20)135261425h34712H2561315H21H3(H2731)
MFCD01877705
ZINC000002272754
ZINC2272754
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