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

Systemtic Name: N-(4-acetamidophenyl)-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C27H26N4O3S/c1-4-19-9-15-22(16-10-19)31-26(34)23-7-5-6-8-24(23)30-27(31)35-17(2)25(33)29-21-13-11-20(12-14-21)28-18(3)32/h5-17H,4H2,1-3H3,(H,28,32)(H,29,33)