N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-5-keto-5-(2-thienyl)valeramide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)CCCC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)CCCC(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H23N3O2S/c1-14-9-11-17(12-10-14)24-16(3)21(15(2)23-24)22-20(26)8-4-6-18(25)19-7-5-13-27-19/h5,7,9-13H,4,6,8H2,1-3H3,(H,22,26)