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

Systemtic Name: 5-methyl-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Openeye Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-5-methyl-tetrahydrofuran-2-one CAS Name: 5-methyl-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-2-oxolanone IUPAC Name: 5-methyl-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Traditional Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-5-methyl-tetrahydrofuran-2-one Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)SC2=NN=C(N2CC=C)C

Isomeric SMILES

CC1CC(C(=O)O1)SC2=NN=C(N2CC=C)C

InChI

InChI=1S/C11H15N3O2S/c1-4-5-14-8(3)12-13-11(14)17-9-6-7(2)16-10(9)15/h4,7,9H,1,5-6H2,2-3H3