N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluoranylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluoranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-[(2-fluorophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4F

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4F

InChI

InChI=1S/C21H19FN4O2S/c22-16-7-4-5-8-18(16)28-13-26-11-10-17(25-26)20(27)24-21-15(12-23)14-6-2-1-3-9-19(14)29-21/h4-5,7-8,10-11H,1-3,6,9,13H2,(H,24,27)