diethyl 5-[2-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-(3-amino-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[2-(3-amino-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[2-(3-amino-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[N'-(3-amino-5-keto-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N5O5S/c1-4-29-19(27)13-11(3)15(20(28)30-5-2)31-17(13)23-22-14-16(21)24-25(18(14)26)12-9-7-6-8-10-12/h6-10,23H,4-5H2,1-3H3,(H2,21,24)