N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(2-thienyl)butanamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-(2-thienyl)butyramide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CCCC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C20H23N3OS/c1-15-19(16(2)23(22-15)17-8-4-3-5-9-17)14-21-20(24)12-6-10-18-11-7-13-25-18/h3-5,7-9,11,13H,6,10,12,14H2,1-2H3,(H,21,24)