Vitas-M small molecule compound
ethyl 5-acetyl-2-{[4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK839591
SMILES CCOC(=O)c1c(NC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc(c1C)C(=O)C
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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 C26H24N2O6S MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S/c1-4-34-26(33)20-14(2)22(15(3)29)35-23(20)27-19(30)12-7-13-28-24(31)17-10-5-8-16-9-6-11-18(21(16)17)25(28)32/h5-6,8-11H,4,7,12-13H2,1-3H3,(H,27,30)InChIKey
UVUOGNGRIKXIEC-UHFFFAOYSA-NSynonyms
326617-34-9326617349
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
ethyl5acetyl2((4(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)butanoyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(4(13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)BUTANAMIDO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5ACETYL2(4(13DIOXOBENZO(DE)ISOQUINOLIN2YL)BUTANOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC26H24N2O6Sc143426(33)2014(2)22(15(3)29)3523(20)2719(30)127132824(31)17105816961118(21(16)17)25(28)32h56811H471213H213H3(H2730)
MFCD01925384
ZINC000008387440
ZINC08387440
ZINC8387440
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