N-phenethyl-N'-[[1-(phenylsulfonyl)pyrrolidin-2-yl]methyl]ethanediamide

Systemtic Name: N-phenethyl-N'-[[1-(phenylsulfonyl)pyrrolidin-2-yl]methyl]ethanediamide Openeye Name: N'-[[1-(benzenesulfonyl)pyrrolidin-2-yl]methyl]-N-phenethyl-oxamide CAS Name: N'-[[1-(benzenesulfonyl)-2-pyrrolidinyl]methyl]-N-phenethyloxamide IUPAC Name: N'-[[1-(benzenesulfonyl)pyrrolidin-2-yl]methyl]-N-phenethyloxamide Traditional Name: N'-[(1-besylpyrrolidin-2-yl)methyl]-N-phenethyl-oxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)CNC(=O)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)CNC(=O)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c25-20(22-14-13-17-8-3-1-4-9-17)21(26)23-16-18-10-7-15-24(18)29(27,28)19-11-5-2-6-12-19/h1-6,8-9,11-12,18H,7,10,13-16H2,(H,22,25)(H,23,26)