N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H21N7OS MolecularWeight: 431.51344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C22H21N7OS/c23-12-16-18(26-27-21(16)24)8-4-10-25-22(30)17-14-29(13-15-6-2-1-3-7-15)28-20(17)19-9-5-11-31-19/h1-3,5-7,9,11,14H,4,8,10,13H2,(H,25,30)(H3,24,26,27)