6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazinylidene)-6,7-dihydro-5H-1-benzothiophen-2-yl]pyridine-2-carboxylic acid

Systemtic Name: 6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazinylidene)-6,7-dihydro-5H-1-benzothiophen-2-yl]pyridine-2-carboxylic acid Openeye Name: 6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazono)-6,7-dihydro-5H-benzothiophen-2-yl]pyridine-2-carboxylic acid CAS Name: 6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazinylidene)-6,7-dihydro-5H-1-benzothiophen-2-yl]-2-pyridinecarboxylic acid IUPAC Name: 6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazinylidene)-6,7-dihydro-5H-1-benzothiophen-2-yl]pyridine-2-carboxylic acid Traditional Name: 6-[(4Z)-4-(1,3-benzothiazol-2-ylhydrazono)-6,7-dihydro-5H-benzothiophen-2-yl]picolinic acid Formula: C21H16N4O2S2 MolecularWeight: 420.50734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(S2)C3=NC(=CC=C3)C(=O)O)C(=NNC4=NC5=CC=CC=C5S4)C1

Isomeric SMILES

C1CC2=C(C=C(S2)C3=NC(=CC=C3)C(=O)O)/C(=N\NC4=NC5=CC=CC=C5S4)/C1

InChI

InChI=1S/C21H16N4O2S2/c26-20(27)16-8-3-7-15(22-16)19-11-12-13(6-4-10-17(12)28-19)24-25-21-23-14-5-1-2-9-18(14)29-21/h1-3,5,7-9,11H,4,6,10H2,(H,23,25)(H,26,27)/b24-13-