Vitas-M small molecule compound

ethyl 4-{[{[(5-{(1Z)-2-cyano-3-[(2-methoxyethyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)methyl]amino}(oxo)acetyl]amino}benzoate

Catalog ID
STL382286
SMILES COCCNC(=O)/C(=C\c1ccc(o1)CNC(=O)C(=O)Nc1ccc(cc1)C(=O)OCC)/C#N

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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 C23H24N4O7 MW 468.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O7/c1-3-33-23(31)15-4-6-17(7-5-15)27-22(30)21(29)26-14-19-9-8-18(34-19)12-16(13-24)20(28)25-10-11-32-2/h4-9,12H,3,10-11,14H2,1-2H3,(H,25,28)(H,26,29)(H,27,30)/b16-12-
InChIKey
PEQXCWNKLGUSNT-VBKFSLOCSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2=CC=C(O2)C=C(C#N)C(=O)NCCOC
COCCNC(=O)C(=Cc1ccc(o1)CNC(=O)C(=O)Nc1ccc(cc1)C(=O)OCC)C#N
ethyl4(((((5((1Z)2cyano3((2methoxyethyl)amino)3oxoprop1en1yl)furan2yl)methyl)amino)(oxo)acetyl)amino)benzoate
ETHYL4((2((5((Z)2CYANO3(2METHOXYETHYLAMINO)3OXOPROP1ENYL)FURAN2YL)METHYLAMINO)2OXOACETYL)AMINO)BENZOATE
ETHYL4((N((5((1Z)2CYANO2(N(2METHOXYETHYL)CARBAMOYL)VINYL)2FURYL)METHYL)CARBAMOYL)CARBONYLAMINO)BENZOATE
InChI=1SC23H24N4O7c133323(31)154617(7515)2722(30)21(29)2614199818(3419)1216(1324)20(28)251011322h4912H3101114H212H3(H2528)(H2629)(H2730)b1612
MFCD02629859
ZINC000006599856
ZINC06599856
ZINC6599856

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Available files

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