(4-azanylquinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C23H16N4O2S MolecularWeight: 412.46374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C23H16N4O2S/c24-22-15-7-2-4-9-18(15)26-21(27-22)13-29-23(28)16-12-19(20-10-5-11-30-20)25-17-8-3-1-6-14(16)17/h1-12H,13H2,(H2,24,26,27)