ethyl 4-cyano-5-[3-cyano-4-[5-(2-methyl-5-nitro-phenyl)furan-2-yl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-cyano-4-[5-(2-methyl-5-nitro-phenyl)furan-2-yl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[3-cyano-4-[5-(2-methyl-5-nitro-phenyl)-2-furyl]-2-oxo-but-3-enyl]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[3-cyano-4-[5-(2-methyl-5-nitrophenyl)-2-furanyl]-2-oxobut-3-enyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-cyano-4-[5-(2-methyl-5-nitrophenyl)furan-2-yl]-2-oxobut-3-enyl]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[3-cyano-2-keto-4-[5-(2-methyl-5-nitro-phenyl)-2-furyl]but-3-enyl]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H19N3O6S MolecularWeight: 489.49986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])C)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])C)C#N)C#N)C

InChI

InChI=1S/C25H19N3O6S/c1-4-33-25(30)24-15(3)20(13-27)23(35-24)11-21(29)16(12-26)9-18-7-8-22(34-18)19-10-17(28(31)32)6-5-14(19)2/h5-10H,4,11H2,1-3H3