Vitas-M small molecule compound
4-ethyl-1-(prop-2-yn-1-ylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK996079
SMILES C#CCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2CC)CCCCC3
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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 C23H24N4OS MW 404.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4OS/c1-3-14-29-22-25-24-21-26(4-2)20(28)18-19(27(21)22)17-11-7-6-10-16(17)15-23(18)12-8-5-9-13-23/h1,6-7,10-11H,4-5,8-9,12-15H2,2H3InChIKey
RRQOBWDBZNQOTD-UHFFFAOYSA-NSynonyms
4ethyl1(prop2yn1ylsulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N5C1=NN=C5SCC#C
InChI=1SC23H24N4OSc1314292225242126(42)20(28)1819(27(21)22)1711761016(17)1523(18)128591323h1671011H45891215H22H3
MFCD03192698
ZINC000002999748
ZINC2999748
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