azane; 2-phenyl-4-[2-(pyridin-3-ylmethylamino)ethanoylamino]benzamide

Systemtic Name: azane; 2-phenyl-4-[2-(pyridin-3-ylmethylamino)ethanoylamino]benzamide Openeye Name: ammonia; 2-phenyl-4-[[2-(3-pyridylmethylamino)acetyl]amino]benzamide CAS Name: ammonia; 4-[[1-oxo-2-(3-pyridinylmethylamino)ethyl]amino]-2-phenylbenzamide IUPAC Name: azane; 2-phenyl-4-[[2-(pyridin-3-ylmethylamino)acetyl]amino]benzamide Traditional Name: ammonia; 2-phenyl-4-[[2-(3-pyridylmethylamino)acetyl]amino]benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)CNCC3=CN=CC=C3)C(=O)N.N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)CNCC3=CN=CC=C3)C(=O)N.N

InChI

InChI=1S/C21H20N4O2.H3N/c22-21(27)18-9-8-17(11-19(18)16-6-2-1-3-7-16)25-20(26)14-24-13-15-5-4-10-23-12-15;/h1-12,24H,13-14H2,(H2,22,27)(H,25,26);1H3