2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-N-(2-phenyl-3,4-dihydropyrazol-5-yl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-N-(2-phenyl-3,4-dihydropyrazol-5-yl)ethanamide Openeye Name: 2-(4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide CAS Name: 2-[(4-oxo-3-phenethyl-2-quinazolinyl)thio]-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide IUPAC Name: 2-(4-oxo-3-phenethylquinazolin-2-yl)sulfanyl-N-(2-phenyl-3,4-dihydropyrazol-5-yl)acetamide Traditional Name: 2-[(4-keto-3-phenethyl-quinazolin-2-yl)thio]-N-(1-phenyl-2-pyrazolin-3-yl)acetamide Formula: C27H25N5O2S MolecularWeight: 483.5847

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(N=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O2S/c33-25(29-24-16-18-32(30-24)21-11-5-2-6-12-21)19-35-27-28-23-14-8-7-13-22(23)26(34)31(27)17-15-20-9-3-1-4-10-20/h1-14H,15-19H2,(H,29,30,33)