N-(4-acetamidophenyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H26N4O3S/c1-14(2)13-27-22(30)19-7-5-6-8-20(19)26-23(27)31-15(3)21(29)25-18-11-9-17(10-12-18)24-16(4)28/h5-12,14-15H,13H2,1-4H3,(H,24,28)(H,25,29)