Vitas-M small molecule compound

diethyl 5-({[3-amino-4-cyano-5-(phenylamino)thiophen-2-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK771865
SMILES CCOC(=O)c1c(NC(=O)c2sc(c(c2N)C#N)Nc2ccccc2)sc(c1C)C(=O)OCC

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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 C23H22N4O5S2 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O5S2/c1-4-31-22(29)15-12(3)17(23(30)32-5-2)33-21(15)27-19(28)18-16(25)14(11-24)20(34-18)26-13-9-7-6-8-10-13/h6-10,26H,4-5,25H2,1-3H3,(H,27,28)
InChIKey
UAOKGUPCBUAMHP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=C(C(=C(S2)NC3=CC=CC=C3)C#N)N
diethyl5(((3amino4cyano5(phenylamino)thiophen2yl)carbonyl)amino)3methylthiophene24dicarboxylate
DIETHYL5((3AMINO5ANILINO4CYANOTHIOPHENE2CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC23H22N4O5S2c143122(29)1512(3)17(23(30)3252)3321(15)2719(28)1816(25)14(1124)20(3418)261397681013h61026H4525H213H3(H2728)
MFCD03373579
ZINC000003624378
ZINC03624378
ZINC3624378

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Available files

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