ethyl 2-(dimethylaminomethylideneamino)-5-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(dimethylaminomethylideneamino)-5-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(dimethylaminomethyleneamino)-5-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-(dimethylaminomethylideneamino)-5-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(dimethylaminomethylideneamino)-5-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]-4-phenylthiophene-3-carboxylate Traditional Name: 2-(dimethylaminomethyleneamino)-5-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)N=CN(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)N=CN(C)C

InChI

InChI=1S/C27H26N4O3S/c1-5-34-27(33)24-23(19-12-8-6-9-13-19)22(35-25(24)28-17-30(3)4)16-21-18(2)29-31(26(21)32)20-14-10-7-11-15-20/h6-17H,5H2,1-4H3