2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide CAS Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(1-imidazolylmethyl)phenyl]acetamide IUPAC Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide Formula: C20H17BrN4O3 MolecularWeight: 441.27798

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)Br)CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)Br)CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C20H17BrN4O3/c21-15-4-5-17-18(9-15)28-12-20(27)25(17)11-19(26)23-16-3-1-2-14(8-16)10-24-7-6-22-13-24/h1-9,13H,10-12H2,(H,23,26)