(2S)-N-aminocarbonyl-2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-aminocarbonyl-2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: (2S)-2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-carbamoyl-propanamide CAS Name: (2S)-2-[[2-(4-bromophenyl)-4-quinazolinyl]thio]-N-carbamoylpropanamide IUPAC Name: (2S)-2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-carbamoylpropanamide Traditional Name: (2S)-2-[[2-(4-bromophenyl)quinazolin-4-yl]thio]-N-carbamoyl-propionamide Formula: C18H15BrN4O2S MolecularWeight: 431.3063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)SC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrN4O2S/c1-10(16(24)23-18(20)25)26-17-13-4-2-3-5-14(13)21-15(22-17)11-6-8-12(19)9-7-11/h2-10H,1H3,(H3,20,23,24,25)/t10-/m0/s1