N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-chloranyl-4,5-dimethoxy-benzamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-chloranyl-4,5-dimethoxy-benzamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-chloro-4,5-dimethoxy-benzamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-3-chloro-4,5-dimethoxybenzamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-3-chloro-4,5-dimethoxybenzamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-chloro-4,5-dimethoxy-benzamide Formula: C22H22ClN5O3 MolecularWeight: 439.89478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C22H22ClN5O3/c1-30-19-12-14(11-17(23)20(19)31-2)22(29)26-10-6-9-18-16(13-24)21(25)28(27-18)15-7-4-3-5-8-15/h3-5,7-8,11-12H,6,9-10,25H2,1-2H3,(H,26,29)