2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-ethanoylphenyl)propanamide

Systemtic Name: 2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-ethanoylphenyl)propanamide Openeye Name: N-(3-acetylphenyl)-2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(3-acetylphenyl)-2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=CC(=C4)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=CC(=C4)C(=O)C

InChI

InChI=1S/C27H25N3O3S/c1-16-9-7-10-17(2)24(16)30-26(33)22-13-5-6-14-23(22)29-27(30)34-19(4)25(32)28-21-12-8-11-20(15-21)18(3)31/h5-15,19H,1-4H3,(H,28,32)