ethyl 4-[(5Z)-2-azanylidene-4-oxidanylidene-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-thiazolidin-3-yl]benzoate

Systemtic Name: ethyl 4-[(5Z)-2-azanylidene-4-oxidanylidene-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-thiazolidin-3-yl]benzoate Openeye Name: ethyl 4-[(5Z)-2-imino-4-oxo-5-[(1-phenylpyrazol-4-yl)methylene]thiazolidin-3-yl]benzoate CAS Name: 4-[(5Z)-2-imino-4-oxo-5-[(1-phenyl-4-pyrazolyl)methylidene]-3-thiazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5Z)-2-imino-4-oxo-5-[(1-phenylpyrazol-4-yl)methylidene]-1,3-thiazolidin-3-yl]benzoate Traditional Name: 4-[(5Z)-2-imino-4-keto-5-[(1-phenylpyrazol-4-yl)methylene]thiazolidin-3-yl]benzoic acid ethyl ester Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CN(N=C3)C4=CC=CC=C4)SC2=N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CN(N=C3)C4=CC=CC=C4)/SC2=N

InChI

InChI=1S/C22H18N4O3S/c1-2-29-21(28)16-8-10-18(11-9-16)26-20(27)19(30-22(26)23)12-15-13-24-25(14-15)17-6-4-3-5-7-17/h3-14,23H,2H2,1H3/b19-12-,23-22?