N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-5-methyl-1-(3-methylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide Formula: C24H28N4O3S MolecularWeight: 452.56912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C24H28N4O3S/c1-18-9-7-11-21(15-18)28-19(2)23(17-25-28)24(29)26-20-10-8-12-22(16-20)32(30,31)27-13-5-3-4-6-14-27/h7-12,15-17H,3-6,13-14H2,1-2H3,(H,26,29)