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

Systemtic Name: N-[(E)-1-(2-fluorophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[(E)-2-(2-fluorophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-3,4-dimethoxy-benzamide CAS Name: N-[(E)-1-(2-fluorophenyl)-3-[3-(1-imidazolyl)propylamino]-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[(E)-1-(2-fluorophenyl)-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[(E)-2-(2-fluorophenyl)-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-3,4-dimethoxy-benzamide Formula: C24H25FN4O4 MolecularWeight: 452.478103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=CC=C2F)C(=O)NCCCN3C=CN=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N/C(=C/C2=CC=CC=C2F)/C(=O)NCCCN3C=CN=C3)OC

InChI

InChI=1S/C24H25FN4O4/c1-32-21-9-8-18(15-22(21)33-2)23(30)28-20(14-17-6-3-4-7-19(17)25)24(31)27-10-5-12-29-13-11-26-16-29/h3-4,6-9,11,13-16H,5,10,12H2,1-2H3,(H,27,31)(H,28,30)/b20-14+