N-[(E)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(E)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(E)-2-[5-(4-bromophenyl)-2-furyl]-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(E)-1-[5-(4-bromophenyl)-2-furanyl]-3-[3-(1-imidazolyl)propylamino]-3-oxoprop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(E)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(E)-2-[5-(4-bromophenyl)-2-furyl]-1-(3-imidazol-1-ylpropylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C27H25BrN4O3 MolecularWeight: 533.4164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(O2)C3=CC=C(C=C3)Br)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(O2)C3=CC=C(C=C3)Br)/C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C27H25BrN4O3/c1-19-3-5-21(6-4-19)26(33)31-24(27(34)30-13-2-15-32-16-14-29-18-32)17-23-11-12-25(35-23)20-7-9-22(28)10-8-20/h3-12,14,16-18H,2,13,15H2,1H3,(H,30,34)(H,31,33)/b24-17+