3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CC=NN3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CC=NN3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H26N4O4S/c1-31-21-10-9-18(16-22(21)32(29,30)27-13-4-2-3-5-14-27)23(28)25-19-8-6-7-17(15-19)20-11-12-24-26-20/h6-12,15-16H,2-5,13-14H2,1H3,(H,24,26)(H,25,28)