N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide

Systemtic Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide Openeye Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2-(N-methylsulfonyl-4-phenoxy-anilino)propanamide CAS Name: N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide IUPAC Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-[4-(2-methylimidazol-1-yl)benzyl]propionamide Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C(C)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C(C)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C27H28N4O4S/c1-20(27(32)29-19-22-9-11-23(12-10-22)30-18-17-28-21(30)2)31(36(3,33)34)24-13-15-26(16-14-24)35-25-7-5-4-6-8-25/h4-18,20H,19H2,1-3H3,(H,29,32)