N-(3-imidazol-1-ylpropyl)-2-[(3-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[(3-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3-imidazol-1-ylpropyl)-2-(3-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-(1-imidazolyl)propyl]-2-(3-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-(3-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-(3-imidazol-1-ylpropyl)-2-(N-mesyl-3-methyl-anilino)acetamide Formula: C16H22N4O3S MolecularWeight: 350.43588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C

InChI

InChI=1S/C16H22N4O3S/c1-14-5-3-6-15(11-14)20(24(2,22)23)12-16(21)18-7-4-9-19-10-8-17-13-19/h3,5-6,8,10-11,13H,4,7,9,12H2,1-2H3,(H,18,21)