3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide

Systemtic Name: 3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Openeye Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propanamide CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide IUPAC Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propionamide Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C23H17N3O2S/c27-22(13-12-21-25-20-9-2-1-8-19(20)23(28)26-21)24-17-6-3-5-16(15-17)10-11-18-7-4-14-29-18/h1-9,14-15H,12-13H2,(H,24,27)(H,25,26,28)