Vitas-M small molecule compound

N-[3-(1H-benzimidazol-2-yl)propyl]-4-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)butanamide

Catalog ID
STL496159
SMILES O=C(CCCN1C(=O)c2ccccc2N2C1c1ccccc1C2=O)NCCCc1nc2c([nH]1)cccc2

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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 C29H27N5O3 MW 493.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O3/c35-26(30-17-7-15-25-31-22-12-4-5-13-23(22)32-25)16-8-18-33-27-19-9-1-2-10-20(19)29(37)34(27)24-14-6-3-11-21(24)28(33)36/h1-6,9-14,27H,7-8,15-18H2,(H,30,35)(H,31,32)
InChIKey
MLDHMHXNAUCBOK-UHFFFAOYSA-N
Synonyms
1630862-58-6
1630862586
91638665
InChI=1SC29H27N5O3c3526(301771525312212451323(22)3225)168183327199121020(19)29(37)34(27)2414631121(24)28(33)36h1691427H781518H2(H3035)(H3132)
MFCD28350155
N(3(1Hbenzimidazol2yl)propyl)4(511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)butanamide
N(3(1Hbenzimidazol2yl)propyl)4(511dioxo6aHisoindolo(21a)quinazolin6yl)butanamide
N(3(1Hbenzo(d)imidazol2yl)propyl)4(511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)butanamide
O=C(CCCN1C(=O)c2ccccc2N2C1c1ccccc1C2=O)NCCCc1nc2c((nH)1)cccc2
ZINC000217929910
ZINC000217930011

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Available files

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