N-[(Z)-3-[(2-bromanyl-4-methyl-phenyl)amino]-1-(4-fluorophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-butyl-benzamide

Systemtic Name: N-[(Z)-3-[(2-bromanyl-4-methyl-phenyl)amino]-1-(4-fluorophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-butyl-benzamide Openeye Name: N-[(Z)-1-[(2-bromo-4-methyl-phenyl)carbamoyl]-2-(4-fluorophenyl)vinyl]-4-butyl-benzamide CAS Name: N-[(Z)-3-(2-bromo-4-methylanilino)-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl]-4-butylbenzamide IUPAC Name: N-[(Z)-3-(2-bromo-4-methylanilino)-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl]-4-butylbenzamide Traditional Name: N-[(Z)-1-[(2-bromo-4-methyl-phenyl)carbamoyl]-2-(4-fluorophenyl)vinyl]-4-butyl-benzamide Formula: C27H26BrFN2O2 MolecularWeight: 509.409943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)F)C(=O)NC3=C(C=C(C=C3)C)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)F)/C(=O)NC3=C(C=C(C=C3)C)Br

InChI

InChI=1S/C27H26BrFN2O2/c1-3-4-5-19-7-11-21(12-8-19)26(32)31-25(17-20-9-13-22(29)14-10-20)27(33)30-24-15-6-18(2)16-23(24)28/h6-17H,3-5H2,1-2H3,(H,30,33)(H,31,32)/b25-17-