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

Systemtic Name: 3-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)-N-propan-2-yl-propanamide Openeye Name: N-isopropyl-3-[1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidin-2-yl]propanamide CAS Name: 3-[4-mercapto-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-N-propan-2-ylpropanamide IUPAC Name: 3-(1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidin-2-yl)-N-propan-2-ylpropanamide Traditional Name: N-isopropyl-3-[4-mercapto-1-(2-naphthylsulfonyl)pyrrolidin-2-yl]propionamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CCC1CC(CN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S

Isomeric SMILES

CC(C)NC(=O)CCC1CC(CN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S

InChI

InChI=1S/C20H26N2O3S2/c1-14(2)21-20(23)10-8-17-12-18(26)13-22(17)27(24,25)19-9-7-15-5-3-4-6-16(15)11-19/h3-7,9,11,14,17-18,26H,8,10,12-13H2,1-2H3,(H,21,23)