4-(2-cyanophenyl)-N-(2-pyridin-2-ylethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(2-cyanophenyl)-N-(2-pyridin-2-ylethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(2-cyanophenyl)-N-[2-(2-pyridyl)ethyl]-1,4-diazepane-1-carboxamide CAS Name: 4-(2-cyanophenyl)-N-[2-(2-pyridinyl)ethyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(2-cyanophenyl)-N-(2-pyridin-2-ylethyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(2-cyanophenyl)-N-[2-(2-pyridyl)ethyl]-1,4-diazepane-1-carboxamide Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=N2)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=N2)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H23N5O/c21-16-17-6-1-2-8-19(17)24-12-5-13-25(15-14-24)20(26)23-11-9-18-7-3-4-10-22-18/h1-4,6-8,10H,5,9,11-15H2,(H,23,26)