4-[3-[2-(1,2-dioxiran-3-yl)piperidin-1-yl]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[3-[2-(1,2-dioxiran-3-yl)piperidin-1-yl]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[3-[2-(dioxiran-3-yl)-1-piperidyl]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[3-[2-(3-dioxiranyl)-1-piperidinyl]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[3-[2-(dioxiran-3-yl)piperidin-1-yl]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[3-[2-(dioxiran-3-yl)piperidino]phenyl]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2OO2)C3=CC=CC(=C3)N4C(=NNC4=S)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C(C1)C2OO2)C3=CC=CC(=C3)N4C(=NNC4=S)C5=CC=CC=C5

InChI

InChI=1S/C20H20N4O2S/c27-20-22-21-18(14-7-2-1-3-8-14)24(20)16-10-6-9-15(13-16)23-12-5-4-11-17(23)19-25-26-19/h1-3,6-10,13,17,19H,4-5,11-12H2,(H,22,27)