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

Systemtic Name: 2-[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-propyl-propanamide Openeye Name: 2-[4-oxo-3-(4-sec-butylphenyl)quinazolin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: 2-[[3-(4-butan-2-ylphenyl)-4-oxo-2-quinazolinyl]thio]-N-propylpropanamide IUPAC Name: 2-[3-(4-butan-2-ylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-propylpropanamide Traditional Name: 2-[[4-keto-3-(4-sec-butylphenyl)quinazolin-2-yl]thio]-N-propyl-propionamide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2S/c1-5-15-25-22(28)17(4)30-24-26-21-10-8-7-9-20(21)23(29)27(24)19-13-11-18(12-14-19)16(3)6-2/h7-14,16-17H,5-6,15H2,1-4H3,(H,25,28)