2-(6-bromanylquinazolin-4-yl)sulfanyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]ethanamide

Systemtic Name: 2-(6-bromanylquinazolin-4-yl)sulfanyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]ethanamide Openeye Name: 2-(6-bromoquinazolin-4-yl)sulfanyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]acetamide CAS Name: 2-[(6-bromo-4-quinazolinyl)thio]-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]acetamide IUPAC Name: 2-(6-bromoquinazolin-4-yl)sulfanyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]acetamide Traditional Name: 2-[(6-bromoquinazolin-4-yl)thio]-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]acetamide Formula: C23H14BrN5O4S MolecularWeight: 536.35736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(O2)C=C(C=C3)[N+](=O)[O-])NC(=O)CSC4=NC=NC5=C4C=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(O2)C=C(C=C3)[N+](=O)[O-])NC(=O)CSC4=NC=NC5=C4C=C(C=C5)Br

InChI

InChI=1S/C23H14BrN5O4S/c24-13-5-7-17-16(9-13)23(26-12-25-17)34-11-21(30)27-18-4-2-1-3-15(18)22-28-19-8-6-14(29(31)32)10-20(19)33-22/h1-10,12H,11H2,(H,27,30)