N-(2-oxidanylideneazepan-3-yl)-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-(2-oxoazepan-3-yl)-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-(2-oxo-3-azepanyl)-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(2-oxoazepan-3-yl)-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(2-ketoazepan-3-yl)-2-(1-phenylpyrazol-4-yl)acetamide Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O2/c22-16(20-15-8-4-5-9-18-17(15)23)10-13-11-19-21(12-13)14-6-2-1-3-7-14/h1-3,6-7,11-12,15H,4-5,8-10H2,(H,18,23)(H,20,22)