[(E)-(1-tert-butyl-3,5-dimethyl-pyrazol-4-yl)methylideneamino] thiophene-2-carboxylate

Systemtic Name: [(E)-(1-tert-butyl-3,5-dimethyl-pyrazol-4-yl)methylideneamino] thiophene-2-carboxylate Openeye Name: [(E)-(1-tert-butyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(E)-(1-tert-butyl-3,5-dimethyl-4-pyrazolyl)methylideneamino] ester IUPAC Name: [(E)-(1-tert-butyl-3,5-dimethylpyrazol-4-yl)methylideneamino] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(E)-(1-tert-butyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino] ester Formula: C15H19N3O2S MolecularWeight: 305.39526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)(C)C)C)C=NOC(=O)C2=CC=CS2

Isomeric SMILES

CC1=C(C(=NN1C(C)(C)C)C)/C=N/OC(=O)C2=CC=CS2

InChI

InChI=1S/C15H19N3O2S/c1-10-12(11(2)18(17-10)15(3,4)5)9-16-20-14(19)13-7-6-8-21-13/h6-9H,1-5H3/b16-9+