N-[[2-(phenoxymethyl)phenyl]methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[[2-(phenoxymethyl)phenyl]methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[[2-(phenoxymethyl)phenyl]methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[[2-(phenoxymethyl)phenyl]methyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[[2-(phenoxymethyl)phenyl]methyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[2-(phenoxymethyl)benzyl]-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC=CC=C3COC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC=CC=C3COC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4S/c30-27(17-14-22-12-15-26(16-13-22)34(31,32)29-18-6-7-19-29)28-20-23-8-4-5-9-24(23)21-33-25-10-2-1-3-11-25/h1-5,8-13,15-16H,6-7,14,17-21H2,(H,28,30)