N-(3-azanylpropyl)-N-[(5-benzamido-2-chloranyl-phenyl)methyl]-4-cyano-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[(5-benzamido-2-chloranyl-phenyl)methyl]-4-cyano-benzamide Openeye Name: N-(3-aminopropyl)-N-[(5-benzamido-2-chloro-phenyl)methyl]-4-cyano-benzamide CAS Name: N-(3-aminopropyl)-N-[(5-benzamido-2-chlorophenyl)methyl]-4-cyanobenzamide IUPAC Name: N-(3-aminopropyl)-N-[(5-benzamido-2-chlorophenyl)methyl]-4-cyanobenzamide Traditional Name: N-(3-aminopropyl)-N-(5-benzamido-2-chloro-benzyl)-4-cyano-benzamide Formula: C25H23ClN4O2 MolecularWeight: 446.92872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H23ClN4O2/c26-23-12-11-22(29-24(31)19-5-2-1-3-6-19)15-21(23)17-30(14-4-13-27)25(32)20-9-7-18(16-28)8-10-20/h1-3,5-12,15H,4,13-14,17,27H2,(H,29,31)