N-[1-(4-bromophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-2-chloranyl-benzamide

Systemtic Name: N-[1-(4-bromophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-2-chloranyl-benzamide Openeye Name: N-[2-(4-bromophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-2-chloro-benzamide CAS Name: N-[1-(4-bromophenyl)-3-[3-(1-imidazolyl)propylamino]-3-oxoprop-1-en-2-yl]-2-chlorobenzamide IUPAC Name: N-[1-(4-bromophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide Traditional Name: N-[2-(4-bromophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-2-chloro-benzamide Formula: C22H20BrClN4O2 MolecularWeight: 487.7768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCCN3C=CN=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCCN3C=CN=C3)Cl

InChI

InChI=1S/C22H20BrClN4O2/c23-17-8-6-16(7-9-17)14-20(27-21(29)18-4-1-2-5-19(18)24)22(30)26-10-3-12-28-13-11-25-15-28/h1-2,4-9,11,13-15H,3,10,12H2,(H,26,30)(H,27,29)