2-[(5-nonyl-1,3,4-thiadiazol-2-yl)sulfanyl]naphthalene-1,4-dione

Systemtic Name: 2-[(5-nonyl-1,3,4-thiadiazol-2-yl)sulfanyl]naphthalene-1,4-dione Openeye Name: 2-[(5-nonyl-1,3,4-thiadiazol-2-yl)sulfanyl]naphthalene-1,4-dione CAS Name: 2-[(5-nonyl-1,3,4-thiadiazol-2-yl)thio]naphthalene-1,4-dione IUPAC Name: 2-[(5-nonyl-1,3,4-thiadiazol-2-yl)sulfanyl]naphthalene-1,4-dione Traditional Name: 2-[(5-nonyl-1,3,4-thiadiazol-2-yl)thio]-1,4-naphthoquinone Formula: C21H24N2O2S2 MolecularWeight: 400.55746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NN=C(S1)SC2=CC(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCCCCC1=NN=C(S1)SC2=CC(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H24N2O2S2/c1-2-3-4-5-6-7-8-13-19-22-23-21(27-19)26-18-14-17(24)15-11-9-10-12-16(15)20(18)25/h9-12,14H,2-8,13H2,1H3