3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)-N-phenethyl-propanamide

Systemtic Name: 3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)-N-phenethyl-propanamide Openeye Name: 3-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)-N-phenethyl-propanamide CAS Name: 3-[4-oxo-2-(phenacylthio)-3-quinazolinyl]-N-phenethylpropanamide IUPAC Name: 3-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)-N-phenethylpropanamide Traditional Name: 3-[4-keto-2-(phenacylthio)quinazolin-3-yl]-N-phenethyl-propionamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3S/c31-24(21-11-5-2-6-12-21)19-34-27-29-23-14-8-7-13-22(23)26(33)30(27)18-16-25(32)28-17-15-20-9-3-1-4-10-20/h1-14H,15-19H2,(H,28,32)