cobalt(2+); 4-methyl-2-oxidanylidene-8-[(E)-(3-sulfanidyl-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate

Systemtic Name: cobalt(2+); 4-methyl-2-oxidanylidene-8-[(E)-(3-sulfanidyl-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Openeye Name: cobaltous 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate CAS Name: cobalt(2+); 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]-1-benzopyran-7-olate IUPAC Name: cobalt(2+); 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Traditional Name: cobaltous 2-keto-4-methyl-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Formula: C13H8CoN4O3S MolecularWeight: 359.22582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C=NN3C=NN=C3[S-])[O-].[Co+2]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2/C=N/N3C=NN=C3[S-])[O-].[Co+2]

InChI

InChI=1S/C13H10N4O3S.Co/c1-7-4-11(19)20-12-8(7)2-3-10(18)9(12)5-15-17-6-14-16-13(17)21;/h2-6,18H,1H3,(H,16,21);/q;+2/p-2/b15-5+;