2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]ethanamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-propyl]-2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: 2-[[2-(4-bromophenyl)-4-quinazolinyl]thio]-N-[(2S)-3-oxo-1-phenylbutan-2-yl]acetamide IUPAC Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-[(2S)-3-oxo-1-phenylbutan-2-yl]acetamide Traditional Name: N-[(1S)-1-benzyl-2-keto-propyl]-2-[[2-(4-bromophenyl)quinazolin-4-yl]thio]acetamide Formula: C26H22BrN3O2S MolecularWeight: 520.44078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H22BrN3O2S/c1-17(31)23(15-18-7-3-2-4-8-18)28-24(32)16-33-26-21-9-5-6-10-22(21)29-25(30-26)19-11-13-20(27)14-12-19/h2-14,23H,15-16H2,1H3,(H,28,32)/t23-/m0/s1