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

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C20H26N4O2/c25-19-6-2-1-3-13-23(19)14-4-11-21-20(26)18-9-7-17(8-10-18)16-24-15-5-12-22-24/h5,7-10,12,15H,1-4,6,11,13-14,16H2,(H,21,26)