N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxidanylidene-3-(pyridin-4-ylmethylamino)prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxidanylidene-3-(pyridin-4-ylmethylamino)prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(Z)-2-[5-(4-bromophenyl)-2-furyl]-1-(4-pyridylmethylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(Z)-1-[5-(4-bromophenyl)-2-furanyl]-3-oxo-3-(pyridin-4-ylmethylamino)prop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxo-3-(pyridin-4-ylmethylamino)prop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(Z)-2-[5-(4-bromophenyl)-2-furyl]-1-(4-pyridylmethylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C27H22BrN3O3 MolecularWeight: 516.38588

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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)NCC4=CC=NC=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)NCC4=CC=NC=C4

InChI

InChI=1S/C27H22BrN3O3/c1-18-2-4-21(5-3-18)26(32)31-24(27(33)30-17-19-12-14-29-15-13-19)16-23-10-11-25(34-23)20-6-8-22(28)9-7-20/h2-16H,17H2,1H3,(H,30,33)(H,31,32)/b24-16-