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

Systemtic Name: 3-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Openeye Name: 3-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Traditional Name: 3-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C11H11N5O2S MolecularWeight: 277.30234

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1SC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

C1COC(=O)C1SC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C11H11N5O2S/c12-16-9(7-2-1-4-13-6-7)14-15-11(16)19-8-3-5-18-10(8)17/h1-2,4,6,8H,3,5,12H2