3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C24H19N3O3S MolecularWeight: 429.49096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCCCN4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCCCN4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C24H19N3O3S/c28-23(30-13-6-12-27-21-10-4-3-9-19(21)26-24(27)29)17-15-20(22-11-5-14-31-22)25-18-8-2-1-7-16(17)18/h1-5,7-11,14-15H,6,12-13H2,(H,26,29)