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

Systemtic Name: 2-[1-naphthalen-2-ylsulfonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]carbonyl-1,5-dihydropyridazin-6-one Openeye Name: 2-[1-(2-naphthylsulfonyl)-4-tritylsulfanyl-pyrrolidine-2-carbonyl]-1,5-dihydropyridazin-6-one CAS Name: 2-[[1-(2-naphthalenylsulfonyl)-4-[(triphenylmethyl)thio]-2-pyrrolidinyl]-oxomethyl]-1,5-dihydropyridazin-6-one IUPAC Name: 2-(1-naphthalen-2-ylsulfonyl-4-tritylsulfanylpyrrolidine-2-carbonyl)-1,5-dihydropyridazin-6-one Traditional Name: 2-[1-(2-naphthylsulfonyl)-4-(tritylthio)prolyl]-1,5-dihydropyridazin-6-one Formula: C38H33N3O4S2 MolecularWeight: 659.81632

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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)SC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C=CN(NC1=O)C(=O)C2CC(CN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)SC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C38H33N3O4S2/c42-36-21-12-24-40(39-36)37(43)35-26-33(27-41(35)47(44,45)34-23-22-28-13-10-11-14-29(28)25-34)46-38(30-15-4-1-5-16-30,31-17-6-2-7-18-31)32-19-8-3-9-20-32/h1-20,22-25,33,35H,21,26-27H2,(H,39,42)