2-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)carbonyl-1,5-dihydropyridazin-6-one

Systemtic Name: 2-(1-naphthalen-2-ylsulfonyl-4-sulfanyl-pyrrolidin-2-yl)carbonyl-1,5-dihydropyridazin-6-one Openeye Name: 2-[1-(2-naphthylsulfonyl)-4-sulfanyl-pyrrolidine-2-carbonyl]-1,5-dihydropyridazin-6-one CAS Name: 2-[[4-mercapto-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-oxomethyl]-1,5-dihydropyridazin-6-one IUPAC Name: 2-(1-naphthalen-2-ylsulfonyl-4-sulfanylpyrrolidine-2-carbonyl)-1,5-dihydropyridazin-6-one Traditional Name: 2-[4-mercapto-1-(2-naphthylsulfonyl)prolyl]-1,5-dihydropyridazin-6-one Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN(NC1=O)C(=O)C2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

C1C=CN(NC1=O)C(=O)C2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C19H19N3O4S2/c23-18-6-3-9-21(20-18)19(24)17-11-15(27)12-22(17)28(25,26)16-8-7-13-4-1-2-5-14(13)10-16/h1-5,7-10,15,17,27H,6,11-12H2,(H,20,23)