4-cyclopropyl-3-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclopropyl-3-[2-oxo-1-phenyl-2-(1-piperidyl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopropyl-3-[[2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclopropyl-3-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclopropyl-3-[(2-keto-1-phenyl-2-piperidino-ethyl)thio]-1H-1,2,4-triazol-5-one Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=NNC(=O)N3C4CC4

Isomeric SMILES

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=NNC(=O)N3C4CC4

InChI

InChI=1S/C18H22N4O2S/c23-16(21-11-5-2-6-12-21)15(13-7-3-1-4-8-13)25-18-20-19-17(24)22(18)14-9-10-14/h1,3-4,7-8,14-15H,2,5-6,9-12H2,(H,19,24)