2-chloranyl-5-[3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-5-sulfanylidene-1,2,4-triazolidin-4-yl]benzoate

Systemtic Name: 2-chloranyl-5-[3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-5-sulfanylidene-1,2,4-triazolidin-4-yl]benzoate Openeye Name: 2-chloro-5-[3-(6-oxocyclohexa-2,4-dien-1-ylidene)-5-thioxo-1,2,4-triazolidin-4-yl]benzoate CAS Name: 2-chloro-5-[3-(6-oxo-1-cyclohexa-2,4-dienylidene)-5-sulfanylidene-1,2,4-triazolidin-4-yl]benzoate IUPAC Name: 2-chloro-5-[3-(6-oxocyclohexa-2,4-dien-1-ylidene)-5-sulfanylidene-1,2,4-triazolidin-4-yl]benzoate Traditional Name: 2-chloro-5-[3-(6-ketocyclohexa-2,4-dien-1-ylidene)-5-thioxo-1,2,4-triazolidin-4-yl]benzoate Formula: C15H9ClN3O3S- MolecularWeight: 346.76826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NNC(=S)N2C3=CC(=C(C=C3)Cl)C(=O)[O-])C(=O)C=C1

Isomeric SMILES

C1=CC(=C2NNC(=S)N2C3=CC(=C(C=C3)Cl)C(=O)[O-])C(=O)C=C1

InChI

InChI=1S/C15H10ClN3O3S/c16-11-6-5-8(7-10(11)14(21)22)19-13(17-18-15(19)23)9-3-1-2-4-12(9)20/h1-7,17H,(H,18,23)(H,21,22)/p-1