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

Systemtic Name: N-methyl-3-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-N-methyl-3-[1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidin-2-yl]propanamide CAS Name: 3-[4-mercapto-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-N-methyl-3-(1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidin-2-yl)propanamide Traditional Name: N-benzyl-3-[4-mercapto-1-(2-naphthylsulfonyl)pyrrolidin-2-yl]-N-methyl-propionamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CCC2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CCC2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C25H28N2O3S2/c1-26(17-19-7-3-2-4-8-19)25(28)14-12-22-16-23(31)18-27(22)32(29,30)24-13-11-20-9-5-6-10-21(20)15-24/h2-11,13,15,22-23,31H,12,14,16-18H2,1H3