2-[(4-cyanophenyl)carbamoyl-ethyl-amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)carbamoyl-ethyl-amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[(4-cyanophenyl)carbamoyl-ethyl-amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]-ethylamino]-N-[2-(4-methoxyphenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)carbamoyl-ethylamino]-N-[2-(4-methoxyphenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[(4-cyanophenyl)carbamoyl-ethyl-amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C28H26N6O3 MolecularWeight: 494.54444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H26N6O3/c1-3-33(28(36)30-22-11-9-20(18-29)10-12-22)19-27(35)31-26-17-25(21-7-5-4-6-8-21)32-34(26)23-13-15-24(37-2)16-14-23/h4-17H,3,19H2,1-2H3,(H,30,36)(H,31,35)