Vitas-M small molecule compound
1-[(3-methylbutyl)sulfanyl]-4-(4-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK524402
SMILES CC(CCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3)C
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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 C30H34N4OS MW 498.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4OS/c1-20(2)15-18-36-29-32-31-28-33(23-13-11-21(3)12-14-23)27(35)25-26(34(28)29)24-10-6-5-9-22(24)19-30(25)16-7-4-8-17-30/h5-6,9-14,20H,4,7-8,15-19H2,1-3H3InChIKey
DHZDVYFDDHJDJN-UHFFFAOYSA-NSynonyms
372495-47-11((3methylbutyl)sulfanyl)4(4methylphenyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
1(isopentylthio)4(ptolyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
372495471
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NN=C6SCCC(C)C
InChI=1SC30H34N4OSc120(2)1518362932312833(23131121(3)121423)27(35)2526(34(28)29)241065922(24)1930(25)167481730h5691420H4781519H213H3
MFCD01942882
ZINC000002276802
ZINC2276802
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