N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetylphenyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(4-acetylphenyl)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(4-acetylphenyl)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetylphenyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C22H23N3O3S/c1-13(2)25-21(28)18-7-5-6-8-19(18)24-22(25)29-15(4)20(27)23-17-11-9-16(10-12-17)14(3)26/h5-13,15H,1-4H3,(H,23,27)