ethyl 4-cyano-3-methyl-5-[(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[(3-oxobenzo[f]chromene-2-carbonyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-(3-oxo-2-benzo[f][1]benzopyranyl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[(3-oxobenzo[f]chromene-2-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-5-[(3-ketobenzo[f]chromene-2-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H16N2O5S MolecularWeight: 432.44854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O)C#N)C

InChI

InChI=1S/C23H16N2O5S/c1-3-29-23(28)19-12(2)17(11-24)21(31-19)25-20(26)16-10-15-14-7-5-4-6-13(14)8-9-18(15)30-22(16)27/h4-10H,3H2,1-2H3,(H,25,26)