Vitas-M small molecule compound
4-(4-methylphenyl)-1-(propylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Catalog ID
STK532320
SMILES CCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCC3
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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 C27H28N4OS MW 456.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4OS/c1-3-16-33-26-29-28-25-30(20-12-10-18(2)11-13-20)24(32)22-23(31(25)26)21-9-5-4-8-19(21)17-27(22)14-6-7-15-27/h4-5,8-13H,3,6-7,14-17H2,1-2H3InChIKey
HIFHEGHZHOURNN-UHFFFAOYSA-NSynonyms
1(propylthio)4(ptolyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclopentan)5(7H)one
4(4methylphenyl)1(propylsulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclopentan)5(7H)one
CCCSC1=NN=C2N1C3=C(C(=O)N2C4=CC=C(C=C4)C)C5(CCCC5)CC6=CC=CC=C63
InChI=1SC27H28N4OSc1316332629282530(20121018(2)111320)24(32)2223(31(25)26)21954819(21)1727(22)14671527h45813H3671417H212H3
MFCD02984987
ZINC000002323215
ZINC2323215
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