Vitas-M small molecule compound
1-(ethylsulfanyl)-4-(4-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Catalog ID
STK531943
SMILES CCSc1nnc2n1c1c3ccccc3CC3(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 C26H26N4OS MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4OS/c1-3-32-25-28-27-24-29(19-12-10-17(2)11-13-19)23(31)21-22(30(24)25)20-9-5-4-8-18(20)16-26(21)14-6-7-15-26/h4-5,8-13H,3,6-7,14-16H2,1-2H3InChIKey
HSQVJIORBXGHHY-UHFFFAOYSA-NSynonyms
1(ethylsulfanyl)4(4methylphenyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclopentan)5(7H)one
1(ethylthio)4(ptolyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclopentan)5(7H)one
CCSC1=NN=C2N1C3=C(C(=O)N2C4=CC=C(C=C4)C)C5(CCCC5)CC6=CC=CC=C63
InChI=1SC26H26N4OSc13322528272429(19121017(2)111319)23(31)2122(30(24)25)20954818(20)1626(21)14671526h45813H3671416H212H3
MFCD02997071
ZINC000002305822
ZINC2305822
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