(5Z)-5-[[1-(4-ethoxycarbonylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-phenylimino-1,3-thiazol-4-olate

Systemtic Name: (5Z)-5-[[1-(4-ethoxycarbonylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-phenylimino-1,3-thiazol-4-olate Openeye Name: (5Z)-5-[[1-(4-ethoxycarbonylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-phenylimino-thiazol-4-olate CAS Name: (5Z)-5-[[1-(4-ethoxycarbonylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-2-phenylimino-4-thiazololate IUPAC Name: (5Z)-5-[[1-(4-ethoxycarbonylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-phenylimino-1,3-thiazol-4-olate Traditional Name: (5Z)-5-[[1-(4-carbethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-phenylimino-3-thiazolin-4-olate Formula: C25H22N3O3S- MolecularWeight: 444.52548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=NC(=NC4=CC=CC=C4)S3)[O-])C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=NC(=NC4=CC=CC=C4)S3)[O-])C

InChI

InChI=1S/C25H23N3O3S/c1-4-31-24(30)18-10-12-21(13-11-18)28-16(2)14-19(17(28)3)15-22-23(29)27-25(32-22)26-20-8-6-5-7-9-20/h5-15H,4H2,1-3H3,(H,26,27,29)/p-1/b22-15-