3-[[(3-cyanophenyl)carbamoylamino]methyl]-N-(2-pyridin-4-ylethyl)benzamide

Systemtic Name: 3-[[(3-cyanophenyl)carbamoylamino]methyl]-N-(2-pyridin-4-ylethyl)benzamide Openeye Name: 3-[[(3-cyanophenyl)carbamoylamino]methyl]-N-[2-(4-pyridyl)ethyl]benzamide CAS Name: 3-[[[(3-cyanoanilino)-oxomethyl]amino]methyl]-N-(2-pyridin-4-ylethyl)benzamide IUPAC Name: 3-[[(3-cyanophenyl)carbamoylamino]methyl]-N-(2-pyridin-4-ylethyl)benzamide Traditional Name: 3-[[(3-cyanophenyl)carbamoylamino]methyl]-N-[2-(4-pyridyl)ethyl]benzamide Formula: C23H21N5O2 MolecularWeight: 399.44514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NCC2=CC=CC(=C2)C(=O)NCCC3=CC=NC=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NCC2=CC=CC(=C2)C(=O)NCCC3=CC=NC=C3)C#N

InChI

InChI=1S/C23H21N5O2/c24-15-18-3-2-6-21(14-18)28-23(30)27-16-19-4-1-5-20(13-19)22(29)26-12-9-17-7-10-25-11-8-17/h1-8,10-11,13-14H,9,12,16H2,(H,26,29)(H2,27,28,30)