(2-sulfanylidenepyridin-3-ylidene)-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methanolate

Systemtic Name: (2-sulfanylidenepyridin-3-ylidene)-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methanolate Openeye Name: (4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)-(2-thioxo-3-pyridylidene)methanolate CAS Name: (2-sulfanylidene-3-pyridinylidene)-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methanolate IUPAC Name: (2-sulfanylidenepyridin-3-ylidene)-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methanolate Traditional Name: (4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)-(2-thioxo-3-pyridylidene)methanolate Formula: C13H12N3OS2- MolecularWeight: 290.38388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=C3C=CC=NC3=S)[O-]

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=C3C=CC=NC3=S)[O-]

InChI

InChI=1S/C13H13N3OS2/c17-11(8-4-3-7-14-12(8)18)16-13-15-9-5-1-2-6-10(9)19-13/h3-4,7,17H,1-2,5-6H2,(H,15,16)/p-1