N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-pyrazol-1-ylphenyl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-pyrazol-1-ylphenyl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[4-(1-pyrazolyl)phenyl]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(4-pyrazol-1-ylphenyl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-pyrazol-1-ylphenyl)acetamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H28N4O3S/c1-19-7-10-21(18-23(19)32(30,31)27-14-4-2-3-5-15-27)26-24(29)17-20-8-11-22(12-9-20)28-16-6-13-25-28/h6-13,16,18H,2-5,14-15,17H2,1H3,(H,26,29)