3-bromanyl-N-[[(3-ethylphenyl)amino]-(4-phenylpiperazin-1-yl)methylidene]benzamide

Systemtic Name: 3-bromanyl-N-[[(3-ethylphenyl)amino]-(4-phenylpiperazin-1-yl)methylidene]benzamide Openeye Name: 3-bromo-N-[(3-ethylanilino)-(4-phenylpiperazin-1-yl)methylene]benzamide CAS Name: 3-bromo-N-[(3-ethylanilino)-(4-phenyl-1-piperazinyl)methylidene]benzamide IUPAC Name: 3-bromo-N-[(3-ethylanilino)-(4-phenylpiperazin-1-yl)methylidene]benzamide Traditional Name: 3-bromo-N-[(3-ethylanilino)-(4-phenylpiperazino)methylene]benzamide Formula: C26H27BrN4O MolecularWeight: 491.42278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=NC(=O)C2=CC(=CC=C2)Br)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=NC(=O)C2=CC(=CC=C2)Br)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H27BrN4O/c1-2-20-8-6-11-23(18-20)28-26(29-25(32)21-9-7-10-22(27)19-21)31-16-14-30(15-17-31)24-12-4-3-5-13-24/h3-13,18-19H,2,14-17H2,1H3,(H,28,29,32)