N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-(p-tolylsulfonylamino)propanamide CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-[2-(imidazol-1-ylmethyl)benzyl]-2-(tosylamino)propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NCC2=CC=CC=C2CN3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NCC2=CC=CC=C2CN3C=CN=C3

InChI

InChI=1S/C21H24N4O3S/c1-16-7-9-20(10-8-16)29(27,28)24-17(2)21(26)23-13-18-5-3-4-6-19(18)14-25-12-11-22-15-25/h3-12,15,17,24H,13-14H2,1-2H3,(H,23,26)