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

Systemtic Name: copper 4-methyl-2-oxidanylidene-8-[(E)-(3-sulfanidyl-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Openeye Name: copper 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate CAS Name: copper 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]-1-benzopyran-7-olate IUPAC Name: copper 4-methyl-2-oxo-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Traditional Name: cupric 2-keto-4-methyl-8-[(E)-(3-sulfido-1,2,4-triazol-4-yl)iminomethyl]chromen-7-olate Formula: C13H8CuN4O3S MolecularWeight: 363.83862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O3S.Cu/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+;