Vitas-M small molecule compound
1-(butylsulfanyl)-4-(2-phenylethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK525638
SMILES CCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2CCc1ccccc1)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 C30H34N4OS MW 498.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4OS/c1-2-3-20-36-29-32-31-28-33(19-16-22-12-6-4-7-13-22)27(35)25-26(34(28)29)24-15-9-8-14-23(24)21-30(25)17-10-5-11-18-30/h4,6-9,12-15H,2-3,5,10-11,16-21H2,1H3InChIKey
QLERRBMHCNBCPU-UHFFFAOYSA-NSynonyms
372495-73-31(butylsulfanyl)4(2phenylethyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
1(butylthio)4phenethyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
372495733
CCCCSC1=NN=C2N1C3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC30H34N4OSc12320362932312833(191622126471322)27(35)2526(34(28)29)2415981423(24)2130(25)17105111830h4691215H23510111621H21H3
MFCD01942938
ZINC000002276844
ZINC2276844
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