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

Systemtic Name: 5-(1-methylsulfonylpiperidin-4-yl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-4-thiophen-2-yl-1,2,4-triazol-3-one Openeye Name: 5-(1-methylsulfonyl-4-piperidyl)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)-4-(2-thienyl)-1,2,4-triazol-3-one CAS Name: 5-(1-methylsulfonyl-4-piperidinyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-thiophen-2-yl-1,2,4-triazol-3-one IUPAC Name: 5-(1-methylsulfonylpiperidin-4-yl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)-4-thiophen-2-yl-1,2,4-triazol-3-one Traditional Name: 2-(2-keto-2-pyrrolidino-ethyl)-5-(1-mesyl-4-piperidyl)-4-(2-thienyl)-1,2,4-triazol-3-one Formula: C18H25N5O4S2 MolecularWeight: 439.5522

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C2=NN(C(=O)N2C3=CC=CS3)CC(=O)N4CCCC4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C2=NN(C(=O)N2C3=CC=CS3)CC(=O)N4CCCC4

InChI

InChI=1S/C18H25N5O4S2/c1-29(26,27)21-10-6-14(7-11-21)17-19-22(13-15(24)20-8-2-3-9-20)18(25)23(17)16-5-4-12-28-16/h4-5,12,14H,2-3,6-11,13H2,1H3