copper(1+); 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate

Systemtic Name: copper(1+); 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate Openeye Name: tricuprous 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate CAS Name: copper(1+); 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate IUPAC Name: copper(1+); 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate Traditional Name: tricuprous 2-[(1S)-1-(dimethylamino)ethyl]benzenethiolate Formula: C30H42Cu3N3S3 MolecularWeight: 731.50758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1[S-])N(C)C.CC(C1=CC=CC=C1[S-])N(C)C.CC(C1=CC=CC=C1[S-])N(C)C.[Cu+].[Cu+].[Cu+]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1[S-])N(C)C.C[C@@H](C1=CC=CC=C1[S-])N(C)C.C[C@@H](C1=CC=CC=C1[S-])N(C)C.[Cu+].[Cu+].[Cu+]

InChI

InChI=1S/3C10H15NS.3Cu/c3*1-8(11(2)3)9-6-4-5-7-10(9)12;;;/h3*4-8,12H,1-3H3;;;/q;;;3*+1/p-3/t3*8-;;;/m000.../s1