3-methyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Openeye Name: 3-methyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide CAS Name: 3-methyl-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-2-thiophenecarboxamide IUPAC Name: 3-methyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Traditional Name: 3-methyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]thiophene-2-carboxamide Formula: C17H17N3OS MolecularWeight: 311.40138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(SC=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C17H17N3OS/c1-13-8-12-22-16(13)17(21)18-10-7-14-3-5-15(6-4-14)20-11-2-9-19-20/h2-6,8-9,11-12H,7,10H2,1H3,(H,18,21)