2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-one

Systemtic Name: 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-one Openeye Name: 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)-4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-one CAS Name: 2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-(3-pyridinyl)-5-thiophen-2-yl-1,2,4-triazol-3-one IUPAC Name: 2-(2-oxo-2-pyrrolidin-1-ylethyl)-4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-one Traditional Name: 2-(2-keto-2-pyrrolidino-ethyl)-4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-one Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C(=O)N(C(=N2)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CN2C(=O)N(C(=N2)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C17H17N5O2S/c23-15(20-8-1-2-9-20)12-21-17(24)22(13-5-3-7-18-11-13)16(19-21)14-6-4-10-25-14/h3-7,10-11H,1-2,8-9,12H2