3-(azepan-1-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(1-pyrazolylmethyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)phenyl]benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C23H26N4O3S/c28-23(25-22-12-4-3-9-20(22)18-26-14-8-13-24-26)19-10-7-11-21(17-19)31(29,30)27-15-5-1-2-6-16-27/h3-4,7-14,17H,1-2,5-6,15-16,18H2,(H,25,28)