Vitas-M small molecule compound

6-{3-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-oxopropyl}-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione

Catalog ID
STL577620
SMILES O=C(N1CCCC1c1nc2c([nH]1)cccc2)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 C29H25N5O3 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O3/c35-25(32-16-7-14-24(32)26-30-21-11-4-5-12-22(21)31-26)15-17-33-27-18-8-1-2-9-19(18)29(37)34(27)23-13-6-3-10-20(23)28(33)36/h1-6,8-13,24,27H,7,14-17H2,(H,30,31)
InChIKey
SSVSJYRMOBCESY-UHFFFAOYSA-N
Synonyms

6(3((S)2(1Hbenzo(d)imidazol2yl)pyrrolidin1yl)3oxopropyl)66adihydroisoindolo(21a)quinazoline511dione
6(3(2(1Hbenzimidazol2yl)pyrrolidin1yl)3oxopropyl)66adihydroisoindolo(21a)quinazoline511dione
InChI=1SC29H25N5O3c3525(321671424(32)26302111451222(21)3126)1517332718812919(18)29(37)34(27)2313631020(23)28(33)36h168132427H71417H2(H3031)
MFCD33396439
O=C(N1CCC(C@H)1c1nc2c((nH)1)cccc2)CCN1C(=O)c2ccccc2N2C1c1ccccc1C2=O

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Available files

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