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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C)C

InChI

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