3-(4-oxidanylidenequinazolin-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-(4-oxidanylidenequinazolin-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]propanamide Openeye Name: 3-(4-oxoquinazolin-3-yl)-N-[2-(3-thienylmethylsulfanyl)phenyl]propanamide CAS Name: 3-(4-oxo-3-quinazolinyl)-N-[2-(3-thiophenylmethylthio)phenyl]propanamide IUPAC Name: 3-(4-oxoquinazolin-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]propanamide Traditional Name: 3-(4-ketoquinazolin-3-yl)-N-[2-(3-thenylthio)phenyl]propionamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C22H19N3O2S2/c26-21(9-11-25-15-23-18-6-2-1-5-17(18)22(25)27)24-19-7-3-4-8-20(19)29-14-16-10-12-28-13-16/h1-8,10,12-13,15H,9,11,14H2,(H,24,26)