2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)ethanamide

Systemtic Name: 2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)ethanamide Openeye Name: 2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)acetamide CAS Name: 2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-phenylphenyl)acetamide IUPAC Name: 2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)acetamide Traditional Name: 2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(2-phenylphenyl)acetamide Formula: C30H25N3O2S MolecularWeight: 491.6034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C30H25N3O2S/c1-2-21-16-18-23(19-17-21)33-29(35)25-13-7-9-15-27(25)32-30(33)36-20-28(34)31-26-14-8-6-12-24(26)22-10-4-3-5-11-22/h3-19H,2,20H2,1H3,(H,31,34)