ethyl (4E)-4-(3-dodecyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylidene)-5-oxidanylidene-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl (4E)-4-(3-dodecyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylidene)-5-oxidanylidene-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl (4E)-4-(3-dodecyl-5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylidene)-5-oxo-1-phenyl-pyrazole-3-carboxylate CAS Name: (4E)-4-(3-dodecyl-5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylidene)-5-oxo-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-4-(3-dodecyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylidene)-5-oxo-1-phenylpyrazole-3-carboxylate Traditional Name: (4E)-5-keto-4-(3-lauryl-5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylidene)-1-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C30H41N3O3S MolecularWeight: 523.72984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=C(CCC2)SC1=C3C(=NN(C3=O)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCN\1C2=C(CCC2)S/C1=C/3\C(=NN(C3=O)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C30H41N3O3S/c1-3-5-6-7-8-9-10-11-12-16-22-32-24-20-17-21-25(24)37-29(32)26-27(30(35)36-4-2)31-33(28(26)34)23-18-14-13-15-19-23/h13-15,18-19H,3-12,16-17,20-22H2,1-2H3/b29-26+