N-(2-oxidanylideneazepan-3-yl)-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-(2-oxoazepan-3-yl)-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-(2-oxo-3-azepanyl)-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-(2-oxoazepan-3-yl)-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-(2-ketoazepan-3-yl)-4-(pyrazol-1-ylmethyl)benzamide Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C17H20N4O2/c22-16(20-15-4-1-2-9-18-17(15)23)14-7-5-13(6-8-14)12-21-11-3-10-19-21/h3,5-8,10-11,15H,1-2,4,9,12H2,(H,18,23)(H,20,22)