Vitas-M small molecule compound
4-(3-methylphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK767686
SMILES Cc1cccc(c1)n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)S
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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/c1-16-8-7-10-18(14-16)28-22(30)20-21(29-23(28)26-27-24(29)31)19-11-4-3-9-17(19)15-25(20)12-5-2-6-13-25/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,27,31)InChIKey
JZLDYFUDNOLZAT-UHFFFAOYSA-NSynonyms
372501-96-71mercapto4(mtolyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4(3methylphenyl)1sulfanyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NNC6=S
InChI=1SC25H24N4OSc116871018(1416)2822(30)2021(2923(28)262724(29)31)191143917(19)1525(20)125261325h3471114H256121315H21H3(H2731)
MFCD01944085
ZINC000002277597
ZINC2277597
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