[4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-2-ethoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-2-ethoxy-phenyl] thiophene-2-carboxylate Openeye Name: [4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-ethoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-(2-amino-3-cyano-4H-benzo[h][1]benzopyran-4-yl)-2-ethoxyphenyl] ester IUPAC Name: [4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-ethoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-ethoxy-phenyl] ester Formula: C27H20N2O4S MolecularWeight: 468.5237

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OC(=O)C5=CC=CS5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OC(=O)C5=CC=CS5

InChI

InChI=1S/C27H20N2O4S/c1-2-31-22-14-17(10-12-21(22)32-27(30)23-8-5-13-34-23)24-19-11-9-16-6-3-4-7-18(16)25(19)33-26(29)20(24)15-28/h3-14,24H,2,29H2,1H3