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

Systemtic Name: 3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[4-methyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: 3-[[4-methyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C)SC3CCOC3=O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C)SC3CCOC3=O

InChI

InChI=1S/C14H15N3O2S/c1-9-4-3-5-10(8-9)12-15-16-14(17(12)2)20-11-6-7-19-13(11)18/h3-5,8,11H,6-7H2,1-2H3