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

Systemtic Name: 3-bromanyl-N-[3-(3-imidazol-1-ylpropylamino)-1-(4-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: 3-bromo-N-[1-(3-imidazol-1-ylpropylcarbamoyl)-2-(4-methoxyphenyl)vinyl]benzamide CAS Name: 3-bromo-N-[3-[3-(1-imidazolyl)propylamino]-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 3-bromo-N-[3-(3-imidazol-1-ylpropylamino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 3-bromo-N-[1-(3-imidazol-1-ylpropylcarbamoyl)-2-(4-methoxyphenyl)vinyl]benzamide Formula: C23H23BrN4O3 MolecularWeight: 483.35772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C(=O)NCCCN2C=CN=C2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C=C(C(=O)NCCCN2C=CN=C2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C23H23BrN4O3/c1-31-20-8-6-17(7-9-20)14-21(27-22(29)18-4-2-5-19(24)15-18)23(30)26-10-3-12-28-13-11-25-16-28/h2,4-9,11,13-16H,3,10,12H2,1H3,(H,26,30)(H,27,29)