(2S)-N,N-diethyl-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N,N-diethyl-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N,N-diethyl-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N,N-diethyl-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N,N-diethyl-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N,N-diethyl-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]propionamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

InChI

InChI=1S/C22H25N3O2S/c1-5-24(6-2)20(26)16(4)28-22-23-19-10-8-7-9-18(19)21(27)25(22)17-13-11-15(3)12-14-17/h7-14,16H,5-6H2,1-4H3/t16-/m0/s1