N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-3-cyano-benzamide

Systemtic Name: N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-3-cyano-benzamide Openeye Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-3-cyano-benzamide CAS Name: N-[2-chloro-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-3-cyanobenzamide IUPAC Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-3-cyanobenzamide Traditional Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-3-cyano-benzamide Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H19ClN4O2/c21-17-6-5-16(20(27)25-9-2-7-23-8-10-25)12-18(17)24-19(26)15-4-1-3-14(11-15)13-22/h1,3-6,11-12,23H,2,7-10H2,(H,24,26)