Vitas-M small molecule compound
(4E)-2-(3-methoxyphenyl)-4-{[(3-methylbutyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Catalog ID
STK578932
SMILES COc1cccc(c1)N1C(=O)/C(=C/NCCC(C)C)/c2c(C1=O)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 C22H24N2O3 MW 364.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O3/c1-15(2)11-12-23-14-20-18-9-4-5-10-19(18)21(25)24(22(20)26)16-7-6-8-17(13-16)27-3/h4-10,13-15,23H,11-12H2,1-3H3/b20-14+InChIKey
LJDZCNBENQDJON-XSFVSMFZSA-NSynonyms
(4E)2(3methoxyphenyl)4(((3methylbutyl)amino)methylidene)isoquinoline13(2H4H)dione
(4E)2(3methoxyphenyl)4((3methylbutylamino)methylidene)isoquinoline13dione
(E)4((isopentylamino)methylene)2(3methoxyphenyl)isoquinoline13(2H4H)dione
CC(C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC=C3)OC
COc1cccc(c1)N1C(=O)C(=CNCCC(C)C)c2c(C1=O)cccc2
InChI=1SC22H24N2O3c115(2)1112231420189451019(18)21(25)24(22(20)26)1676817(1316)273h410131523H1112H213H3b2014+
MFCD06591255
ZINC000006906656
ZINC06906656
ZINC6906656
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