N-[(4Z)-4-(4-naphthalen-1-yl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]methanesulfonamide

Systemtic Name: N-[(4Z)-4-(4-naphthalen-1-yl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]methanesulfonamide Openeye Name: N-[(4Z)-4-[4-(1-naphthyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]-3-oxo-cyclohexa-1,5-dien-1-yl]methanesulfonamide CAS Name: N-[(4Z)-4-[4-(1-naphthalenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-3-oxo-1-cyclohexa-1,5-dienyl]methanesulfonamide IUPAC Name: N-[(4Z)-4-(4-naphthalen-1-yl-5-sulfanylidene-1,2,4-triazolidin-3-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]methanesulfonamide Traditional Name: N-[(4Z)-3-keto-4-[4-(1-naphthyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-1,5-dien-1-yl]methanesulfonamide Formula: C19H16N4O3S2 MolecularWeight: 412.48534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=O)C(=C2NNC(=S)N2C3=CC=CC4=CC=CC=C43)C=C1

Isomeric SMILES

CS(=O)(=O)NC1=CC(=O)/C(=C/2\NNC(=S)N2C3=CC=CC4=CC=CC=C43)/C=C1

InChI

InChI=1S/C19H16N4O3S2/c1-28(25,26)22-13-9-10-15(17(24)11-13)18-20-21-19(27)23(18)16-8-4-6-12-5-2-3-7-14(12)16/h2-11,20,22H,1H3,(H,21,27)/b18-15+