zinc benzimidazol-1-ium-2-ylidene-[(4-methylphenyl)amino]methanethiolate

Systemtic Name: zinc benzimidazol-1-ium-2-ylidene-[(4-methylphenyl)amino]methanethiolate Openeye Name: zinc benzimidazol-1-ium-2-ylidene-(4-methylanilino)methanethiolate CAS Name: zinc 2-benzimidazol-1-iumylidene-(4-methylanilino)methanethiolate IUPAC Name: zinc benzimidazol-1-ium-2-ylidene-(4-methylanilino)methanethiolate Traditional Name: zinc benzimidazol-1-ium-2-ylidene(p-toluidino)methanethiolate Formula: C30H26N6S2Zn+2 MolecularWeight: 600.10664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C2[NH+]=C3C=CC=CC3=N2)[S-].CC1=CC=C(C=C1)NC(=C2[NH+]=C3C=CC=CC3=N2)[S-].[Zn+2]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=C2[NH+]=C3C=CC=CC3=N2)[S-].CC1=CC=C(C=C1)NC(=C2[NH+]=C3C=CC=CC3=N2)[S-].[Zn+2]

InChI

InChI=1S/2C15H13N3S.Zn/c2*1-10-6-8-11(9-7-10)16-15(19)14-17-12-4-2-3-5-13(12)18-14;/h2*2-9,16,19H,1H3;/q;;+2