5-tert-butyl-2-[(3-methylphenyl)methyl]-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-2-[(3-methylphenyl)methyl]-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-2-(m-tolylmethyl)-N-(2-thienylmethyl)pyrazole-3-carboxamide CAS Name: 5-tert-butyl-2-[(3-methylphenyl)methyl]-N-(thiophen-2-ylmethyl)-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-2-[(3-methylphenyl)methyl]-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-2-(3-methylbenzyl)-N-(2-thenyl)pyrazole-3-carboxamide Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=N2)C(C)(C)C)C(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=N2)C(C)(C)C)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C21H25N3OS/c1-15-7-5-8-16(11-15)14-24-18(12-19(23-24)21(2,3)4)20(25)22-13-17-9-6-10-26-17/h5-12H,13-14H2,1-4H3,(H,22,25)