N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[[4-(1-imidazolylmethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-(imidazol-1-ylmethyl)benzyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C23H26N4O3S/c1-18-4-10-21(11-5-18)31(29,30)27-13-2-3-22(27)23(28)25-15-19-6-8-20(9-7-19)16-26-14-12-24-17-26/h4-12,14,17,22H,2-3,13,15-16H2,1H3,(H,25,28)