2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide

Systemtic Name: 2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Openeye Name: 2-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide CAS Name: 2-[[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-ethoxyphenyl)propanamide IUPAC Name: 2-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Traditional Name: 2-[[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-o-phenetyl-propionamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H27N3O3S/c1-5-33-24-13-9-8-12-22(24)28-25(31)19(4)34-27-29-21-11-7-6-10-20(21)26(32)30(27)23-16-17(2)14-15-18(23)3/h6-16,19H,5H2,1-4H3,(H,28,31)