N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(p-tolylmethylsulfanyl)acetamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-[(4-methylphenyl)methylthio]acetamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-[(4-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-[(4-methylbenzyl)thio]acetamide Formula: C23H25N5OS MolecularWeight: 419.5425

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C23H25N5OS/c1-17-9-11-18(12-10-17)15-30-16-22(29)26-13-5-8-21-20(14-24)23(25)28(27-21)19-6-3-2-4-7-19/h2-4,6-7,9-12H,5,8,13,15-16,25H2,1H3,(H,26,29)