4-[2-[(Z)-[2-[(4-fluorophenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]pyrrol-1-yl]benzoate

Systemtic Name: 4-[2-[(Z)-[2-[(4-fluorophenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]pyrrol-1-yl]benzoate Openeye Name: 4-[2-[(Z)-[2-(4-fluoroanilino)-4-oxo-thiazol-5-ylidene]methyl]pyrrol-1-yl]benzoate CAS Name: 4-[2-[(Z)-[2-(4-fluoroanilino)-4-oxo-5-thiazolylidene]methyl]-1-pyrrolyl]benzoate IUPAC Name: 4-[2-[(Z)-[2-(4-fluoroanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2-[(Z)-[2-(4-fluoroanilino)-4-keto-2-thiazolin-5-ylidene]methyl]pyrrol-1-yl]benzoate Formula: C21H13FN3O3S- MolecularWeight: 406.409623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1=CN(C(=C1)/C=C\2/C(=O)N=C(S2)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C21H14FN3O3S/c22-14-5-7-15(8-6-14)23-21-24-19(26)18(29-21)12-17-2-1-11-25(17)16-9-3-13(4-10-16)20(27)28/h1-12H,(H,27,28)(H,23,24,26)/p-1/b18-12-