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

Systemtic Name: diethyl 3-methyl-5-[[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5S/c1-5-29-21(27)17-13(3)18(22(28)30-6-2)31-19(17)23-12-16-14(4)24-25(20(16)26)15-10-8-7-9-11-15/h7-12,23H,5-6H2,1-4H3/b16-12-