Vitas-M small molecule compound

12-(2-phenylethyl)-9-[(2-phenylethyl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one

Catalog ID
STK556075
SMILES O=c1n2c(SCCc3ccccc3)nnc2n(c2c1C1(CCCC1)Cc1c2cccc1)CCc1ccccc1

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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 C33H32N4OS MW 532.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N4OS/c38-30-28-29(27-16-8-7-15-26(27)23-33(28)19-9-10-20-33)36(21-17-24-11-3-1-4-12-24)31-34-35-32(37(30)31)39-22-18-25-13-5-2-6-14-25/h1-8,11-16H,9-10,17-23H2
InChIKey
LMTDKQIOIODEEM-UHFFFAOYSA-N
Synonyms
843623-28-9
12(2phenylethyl)9((2phenylethyl)sulfanyl)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclopentan)7(12H)one
12phenethyl9(phenethylthio)5Hspiro(benzo(h)(124)triazolo(34b)quinazoline61cyclopentan)7(12H)one
C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N5C(=NN=C5SCCC6=CC=CC=C6)N4CCC7=CC=CC=C7
Registry IDs
MFCD04015527
ZINC000002437541
ZINC2437541

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Available files

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