3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methyl]imidazol-4-olate

Systemtic Name: 3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methyl]imidazol-4-olate Openeye Name: 3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-thioxocyclohexa-2,4-dien-1-ylidene)methyl]imidazol-4-olate CAS Name: 3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-sulfanylidene-1-cyclohexa-2,4-dienylidene)methyl]-4-imidazololate IUPAC Name: 3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methyl]imidazol-4-olate Traditional Name: 3-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-2-phenyl-5-[(6-thioxocyclohexa-2,4-dien-1-ylidene)methyl]imidazol-4-olate Formula: C25H18N3O3S2- MolecularWeight: 472.55872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N3C(=C(N=C3C4=CC=CC=C4)C=C5C=CC=CC5=S)[O-]

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N3C(=C(N=C3C4=CC=CC=C4)C=C5C=CC=CC5=S)[O-]

InChI

InChI=1S/C25H19N3O3S2/c1-30-18-12-13-19(31-2)22-21(18)27-25(33-22)28-23(15-8-4-3-5-9-15)26-17(24(28)29)14-16-10-6-7-11-20(16)32/h3-14,29H,1-2H3/p-1