(4Z)-3-oxidanyl-4-[4-(4-propan-2-yloxynaphthalen-1-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-3-oxidanyl-4-[4-(4-propan-2-yloxynaphthalen-1-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-3-hydroxy-4-[4-(4-isopropoxy-1-naphthyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-3-hydroxy-4-[4-(4-propan-2-yloxy-1-naphthalenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-3-hydroxy-4-[4-(4-propan-2-yloxynaphthalen-1-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-3-hydroxy-4-[4-(4-isopropoxy-1-naphthyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C2=CC=CC=C21)N3C(=C4C=CC(=O)C=C4O)NNC3=S

Isomeric SMILES

CC(C)OC1=CC=C(C2=CC=CC=C21)N3/C(=C/4\C=CC(=O)C=C4O)/NNC3=S

InChI

InChI=1S/C21H19N3O3S/c1-12(2)27-19-10-9-17(14-5-3-4-6-15(14)19)24-20(22-23-21(24)28)16-8-7-13(25)11-18(16)26/h3-12,22,26H,1-2H3,(H,23,28)/b20-16+