N-[(E)-1-(2-fluorophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(E)-1-(2-fluorophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(E)-2-(2-fluorophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(E)-1-(2-fluorophenyl)-3-[3-(1-imidazolyl)propylamino]-3-oxoprop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(E)-1-(2-fluorophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(E)-2-(2-fluorophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C23H23FN4O2 MolecularWeight: 406.452723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CC=C2F)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CC=C2F)/C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C23H23FN4O2/c1-17-7-9-18(10-8-17)22(29)27-21(15-19-5-2-3-6-20(19)24)23(30)26-11-4-13-28-14-12-25-16-28/h2-3,5-10,12,14-16H,4,11,13H2,1H3,(H,26,30)(H,27,29)/b21-15+