2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[(E)-1-[4-(1-imidazolyl)phenyl]ethylideneamino]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]acetamide Formula: C21H21BrN4OS MolecularWeight: 457.38664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NN=C(C)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N/N=C(\C)/C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C21H21BrN4OS/c1-14-11-20(15(2)10-19(14)22)28-12-21(27)25-24-16(3)17-4-6-18(7-5-17)26-9-8-23-13-26/h4-11,13H,12H2,1-3H3,(H,25,27)/b24-16+