3-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)-N-(phenylmethyl)propanamide

Systemtic Name: 3-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-[1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidin-2-yl]propanamide CAS Name: 3-[4-mercapto-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidin-2-yl)propanamide Traditional Name: N-benzyl-3-[4-mercapto-1-(2-naphthylsulfonyl)pyrrolidin-2-yl]propionamide Formula: C24H26N2O3S2 MolecularWeight: 454.60484

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CCC(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

C1C(CN(C1CCC(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C24H26N2O3S2/c27-24(25-16-18-6-2-1-3-7-18)13-11-21-15-22(30)17-26(21)31(28,29)23-12-10-19-8-4-5-9-20(19)14-23/h1-10,12,14,21-22,30H,11,13,15-17H2,(H,25,27)