2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-propyl-propanamide

Systemtic Name: 2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-propyl-propanamide Openeye Name: 2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: 2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-N-propylpropanamide IUPAC Name: 2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-propylpropanamide Traditional Name: 2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-N-propyl-propionamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C(C)C

Isomeric SMILES

CCCNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C(C)C

InChI

InChI=1S/C23H27N3O2S/c1-5-14-24-21(27)16(4)29-23-25-19-12-8-6-11-18(19)22(28)26(23)20-13-9-7-10-17(20)15(2)3/h6-13,15-16H,5,14H2,1-4H3,(H,24,27)