N-(2,5-dimethylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-2-phenyl-acetamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C(C)C

InChI

InChI=1S/C27H27N3O2S/c1-17(2)30-26(32)21-12-8-9-13-22(21)29-27(30)33-24(20-10-6-5-7-11-20)25(31)28-23-16-18(3)14-15-19(23)4/h5-17,24H,1-4H3,(H,28,31)