diethyl 3-methyl-5-[(2E)-2-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)hydrazinyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(2E)-2-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)hydrazinyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(2E)-2-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)hydrazino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[(2E)-2-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)hydrazinyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(2E)-2-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)hydrazinyl]thiophene-2,4-dicarboxylate Traditional Name: 5-[(N'E)-N'-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)hydrazino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NN=C2C(=C)NN(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N/N=C/2\C(=C)NN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O5S/c1-5-29-20(27)15-12(3)17(21(28)30-6-2)31-18(15)23-22-16-13(4)24-25(19(16)26)14-10-8-7-9-11-14/h7-11,23-24H,4-6H2,1-3H3/b22-16+