2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(cyclopropylcarbamoyl)ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(cyclopropylcarbamoyl)ethanamide Openeye Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(cyclopropylcarbamoyl)acetamide CAS Name: 2-[[2-(4-bromophenyl)-4-quinazolinyl]thio]-N-[(cyclopropylamino)-oxomethyl]acetamide IUPAC Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(cyclopropylcarbamoyl)acetamide Traditional Name: 2-[[2-(4-bromophenyl)quinazolin-4-yl]thio]-N-(cyclopropylcarbamoyl)acetamide Formula: C20H17BrN4O2S MolecularWeight: 457.34358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1NC(=O)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H17BrN4O2S/c21-13-7-5-12(6-8-13)18-23-16-4-2-1-3-15(16)19(25-18)28-11-17(26)24-20(27)22-14-9-10-14/h1-8,14H,9-11H2,(H2,22,24,26,27)