(4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H15N3O3S MolecularWeight: 413.4485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C23H15N3O3S/c27-22-15-7-2-4-9-18(15)25-21(26-22)13-29-23(28)16-12-19(20-10-5-11-30-20)24-17-8-3-1-6-14(16)17/h1-12H,13H2,(H,25,26,27)