N-(2-ethyl-6-methyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C22H28N2O3S/c1-3-19-8-6-7-17(2)22(19)23-21(25)14-11-18-9-12-20(13-10-18)28(26,27)24-15-4-5-16-24/h6-10,12-13H,3-5,11,14-16H2,1-2H3,(H,23,25)