3-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide Openeye Name: 3-methyl-N-[1-(o-tolylmethyl)pyrazol-4-yl]thiophene-2-carboxamide CAS Name: 3-methyl-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: 3-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide Traditional Name: 3-methyl-N-[1-(2-methylbenzyl)pyrazol-4-yl]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)NC2=CN(N=C2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC2=CN(N=C2)CC3=CC=CC=C3C

InChI

InChI=1S/C17H17N3OS/c1-12-5-3-4-6-14(12)10-20-11-15(9-18-20)19-17(21)16-13(2)7-8-22-16/h3-9,11H,10H2,1-2H3,(H,19,21)