N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H28N2O3S2/c1-23(17-19-5-10-20(28-2)11-6-19)22(25)14-9-18-7-12-21(13-8-18)29(26,27)24-15-3-4-16-24/h5-8,10-13H,3-4,9,14-17H2,1-2H3