3-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one

Systemtic Name: 3-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-(phenylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Traditional Name: 3-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1SC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1COC(=O)C1SC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C18H16N4O2S/c23-17-15(8-10-24-17)25-18-21-20-16(14-7-4-9-19-11-14)22(18)12-13-5-2-1-3-6-13/h1-7,9,11,15H,8,10,12H2