benzenethiolate; N2,N3-bis(oxidanidyl)butane-2,3-diimine; 4-tert-butylpyridine; cobalt

Systemtic Name: benzenethiolate; N2,N3-bis(oxidanidyl)butane-2,3-diimine; 4-tert-butylpyridine; cobalt Openeye Name: benzenethiolate; 4-tert-butylpyridine; cobalt; N2,N3-dioxidobutane-2,3-diimine CAS Name: benzenethiolate; 4-tert-butylpyridine; cobalt; N2,N3-dioxidobutane-2,3-diimine IUPAC Name: benzenethiolate; 4-tert-butylpyridine; cobalt; 2-N,3-N-dioxidobutane-2,3-diimine Traditional Name: benzenethiolate; 4-tert-butylpyridine; cobalt; (1-methyl-2-oxidoimino-propylidene)-oxido-amine Formula: C23H30CoN5O4S-5 MolecularWeight: 531.5136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[O-])C(=N[O-])C.CC(=N[O-])C(=N[O-])C.CC(C)(C)C1=CC=NC=C1.C1=CC=C(C=C1)[S-].[Co]

Isomeric SMILES

CC(=N[O-])C(=N[O-])C.CC(=N[O-])C(=N[O-])C.CC(C)(C)C1=CC=NC=C1.C1=CC=C(C=C1)[S-].[Co]

InChI

InChI=1S/C9H13N.C6H6S.2C4H8N2O2.Co/c1-9(2,3)8-4-6-10-7-5-8;7-6-4-2-1-3-5-6;2*1-3(5-7)4(2)6-8;/h4-7H,1-3H3;1-5,7H;2*7-8H,1-2H3;/p-5