2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-N-[4-[phenyl(propan-2-yl)amino]phenyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-N-[4-[phenyl(propan-2-yl)amino]phenyl]ethanamide Openeye Name: N-[4-(N-isopropylanilino)phenyl]-2-(4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(4-oxo-3-phenethyl-2-quinazolinyl)thio]-N-[4-(N-propan-2-ylanilino)phenyl]acetamide IUPAC Name: 2-(4-oxo-3-phenethylquinazolin-2-yl)sulfanyl-N-[4-(N-propan-2-ylanilino)phenyl]acetamide Traditional Name: N-[4-(N-isopropylanilino)phenyl]-2-[(4-keto-3-phenethyl-quinazolin-2-yl)thio]acetamide Formula: C33H32N4O2S MolecularWeight: 548.69778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5

InChI

InChI=1S/C33H32N4O2S/c1-24(2)37(27-13-7-4-8-14-27)28-19-17-26(18-20-28)34-31(38)23-40-33-35-30-16-10-9-15-29(30)32(39)36(33)22-21-25-11-5-3-6-12-25/h3-20,24H,21-23H2,1-2H3,(H,34,38)