N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide Formula: C23H34N4O3S MolecularWeight: 446.60606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H34N4O3S/c1-17(2)16-27-19(4)22(18(3)25-27)15-23(28)24-20-10-9-11-21(14-20)31(29,30)26-12-7-5-6-8-13-26/h9-11,14,17H,5-8,12-13,15-16H2,1-4H3,(H,24,28)