N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-[(4-methoxyphenyl)amino]benzamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-[(4-methoxyphenyl)amino]benzamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-methoxyanilino)benzamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-(4-methoxyanilino)benzamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-(4-methoxyanilino)benzamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(p-anisidino)benzamide Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C27H26N6O2/c1-35-21-15-13-19(14-16-21)31-24-11-6-5-10-22(24)27(34)30-17-7-12-25-23(18-28)26(29)33(32-25)20-8-3-2-4-9-20/h2-6,8-11,13-16,31H,7,12,17,29H2,1H3,(H,30,34)