ethyl (5E)-5-(3-ethyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-(1,3-thiazol-4-yl)-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl (5E)-5-(3-ethyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-(1,3-thiazol-4-yl)-1,2-dihydropyrazole-3-carboxylate Openeye Name: ethyl (5E)-5-(3-ethyl-4-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-4-thiazol-4-yl-1,2-dihydropyrazole-3-carboxylate CAS Name: (5E)-5-(3-ethyl-4-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-(4-thiazolyl)-1,2-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(1,3-thiazol-4-yl)-1,2-dihydropyrazole-3-carboxylate Traditional Name: (5E)-5-(3-ethyl-4-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-4-thiazol-4-yl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C17H17N3O4S MolecularWeight: 359.39958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=C(NN2)C(=O)OCC)C3=CSC=N3)C(=O)C=C1O

Isomeric SMILES

CCC1=C/C(=C\2/C(=C(NN2)C(=O)OCC)C3=CSC=N3)/C(=O)C=C1O

InChI

InChI=1S/C17H17N3O4S/c1-3-9-5-10(13(22)6-12(9)21)15-14(11-7-25-8-18-11)16(20-19-15)17(23)24-4-2/h5-8,19-21H,3-4H2,1-2H3/b15-10+