4-[4-[[(2R)-oxolan-2-yl]methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-[[(2R)-2-oxolanyl]methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=C3C=CC(=O)C=C3)NNC2=S

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=C3C=CC(=O)C=C3)NNC2=S

InChI

InChI=1S/C13H15N3O2S/c17-10-5-3-9(4-6-10)12-14-15-13(19)16(12)8-11-2-1-7-18-11/h3-6,11,14H,1-2,7-8H2,(H,15,19)/t11-/m1/s1