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

Systemtic Name: 3-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: 3-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SC3CCOC3=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SC3CCOC3=O

InChI

InChI=1S/C13H14N4O2S/c1-8-2-4-9(5-3-8)11-15-16-13(17(11)14)20-10-6-7-19-12(10)18/h2-5,10H,6-7,14H2,1H3