3-bromanyl-N-[(4-cyclohexylpiperazin-1-yl)-[(3-methylphenyl)amino]methylidene]benzamide

Systemtic Name: 3-bromanyl-N-[(4-cyclohexylpiperazin-1-yl)-[(3-methylphenyl)amino]methylidene]benzamide Openeye Name: 3-bromo-N-[(4-cyclohexylpiperazin-1-yl)-(3-methylanilino)methylene]benzamide CAS Name: 3-bromo-N-[(4-cyclohexyl-1-piperazinyl)-(3-methylanilino)methylidene]benzamide IUPAC Name: 3-bromo-N-[(4-cyclohexylpiperazin-1-yl)-(3-methylanilino)methylidene]benzamide Traditional Name: 3-bromo-N-[(4-cyclohexylpiperazino)-(m-toluidino)methylene]benzamide Formula: C25H31BrN4O MolecularWeight: 483.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=NC(=O)C2=CC(=CC=C2)Br)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=NC(=O)C2=CC(=CC=C2)Br)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C25H31BrN4O/c1-19-7-5-10-22(17-19)27-25(28-24(31)20-8-6-9-21(26)18-20)30-15-13-29(14-16-30)23-11-3-2-4-12-23/h5-10,17-18,23H,2-4,11-16H2,1H3,(H,27,28,31)