2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-[4-(pyrazol-1-ylmethyl)benzyl]acetamide Formula: C22H26N4O3S MolecularWeight: 426.53184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)C

InChI

InChI=1S/C22H26N4O3S/c1-17-5-10-21(13-18(17)2)30(28,29)25(3)16-22(27)23-14-19-6-8-20(9-7-19)15-26-12-4-11-24-26/h4-13H,14-16H2,1-3H3,(H,23,27)