3-[4-(2-methylpropoxy)phenyl]-1-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-[4-(2-methylpropoxy)phenyl]-1-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-(4-isobutoxyphenyl)-1-phenyl-N-thiazol-2-yl-pyrazole-4-carboxamide CAS Name: 3-[4-(2-methylpropoxy)phenyl]-1-phenyl-N-(2-thiazolyl)-4-pyrazolecarboxamide IUPAC Name: 3-[4-(2-methylpropoxy)phenyl]-1-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 3-(4-isobutoxyphenyl)-1-phenyl-N-thiazol-2-yl-pyrazole-4-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=NC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=NC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-16(2)15-29-19-10-8-17(9-11-19)21-20(22(28)25-23-24-12-13-30-23)14-27(26-21)18-6-4-3-5-7-18/h3-14,16H,15H2,1-2H3,(H,24,25,28)