3-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=NNC(=S)N4C5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=NNC(=S)N4C5=CC=CC=C5

InChI

InChI=1S/C22H20N4O2S2/c27-30(28,19-13-12-16-7-4-5-8-17(16)15-19)25-14-6-11-20(25)21-23-24-22(29)26(21)18-9-2-1-3-10-18/h1-5,7-10,12-13,15,20H,6,11,14H2,(H,24,29)