Vitas-M small molecule compound

3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]propanamide

Catalog ID
STL568257
SMILES COCc1[nH]nc(n1)NC(=O)CCN1C(=O)c2ccccc2N2C1c1ccccc1C2=O

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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 C22H20N6O4 MW 432.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O4/c1-32-12-17-23-22(26-25-17)24-18(29)10-11-27-19-13-6-2-3-7-14(13)21(31)28(19)16-9-5-4-8-15(16)20(27)30/h2-9,19H,10-12H2,1H3,(H2,23,24,25,26,29)
InChIKey
HMVVMTDDJDGOBU-UHFFFAOYSA-N
Synonyms

128962952
3(511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)N(5(methoxymethyl)1H124triazol3yl)propanamide
3(511dioxo6aHisoindolo(21a)quinazolin6yl)N(5(methoxymethyl)1H124triazol3yl)propanamide
3(511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)N(3(methoxymethyl)1H124triazol5yl)propanamide
COCc1n(nH)c(n1)NC(=O)CCN1C(=O)c2ccccc2N2C1c1ccccc1C2=O
InChI=1SC22H20N6O4c13212172322(262517)2418(29)1011271913623714(13)21(31)28(19)16954815(16)20(27)30h2919H1012H21H3(H22324252629)
MFCD32653374
ZINC000524733315
ZINC000524733316

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Available files

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