6-[4-(1,3-benzodioxol-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(1,3-benzodioxol-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(1,3-benzodioxol-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(1,3-benzodioxol-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(1,3-benzodioxol-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(1,3-benzodioxol-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C(=C4C=CC=CC4=O)NNC3=S

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C(=C4C=CC=CC4=O)NNC3=S

InChI

InChI=1S/C15H11N3O3S/c19-11-4-2-1-3-10(11)14-16-17-15(22)18(14)9-5-6-12-13(7-9)21-8-20-12/h1-7,16H,8H2,(H,17,22)