copper phenylazaniumylidene(quinolin-2-yl)methanethiolate

Systemtic Name: copper phenylazaniumylidene(quinolin-2-yl)methanethiolate Openeye Name: copper phenyliminio(2-quinolyl)methanethiolate CAS Name: copper phenyliminio(2-quinolinyl)methanethiolate IUPAC Name: copper phenylazaniumylidene(quinolin-2-yl)methanethiolate Traditional Name: cupric phenyliminio(2-quinolyl)methanethiolate Formula: C32H24CuN4S2+2 MolecularWeight: 592.23576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[NH+]=C(C2=NC3=CC=CC=C3C=C2)[S-].C1=CC=C(C=C1)[NH+]=C(C2=NC3=CC=CC=C3C=C2)[S-].[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)[NH+]=C(C2=NC3=CC=CC=C3C=C2)[S-].C1=CC=C(C=C1)[NH+]=C(C2=NC3=CC=CC=C3C=C2)[S-].[Cu+2]

InChI

InChI=1S/2C16H12N2S.Cu/c2*19-16(17-13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)18-15;/h2*1-11H,(H,17,19);/q;;+2