N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-phenethyl-amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-phenethyl-amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-phenethyl-amino]acetamide CAS Name: N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]-2-[[(3-cyanoanilino)-oxomethyl]-phenethylamino]acetamide IUPAC Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-phenethylamino]acetamide Traditional Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-phenethyl-amino]acetamide Formula: C31H31ClN6O2 MolecularWeight: 555.06984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CCC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N)C4=CC=CC=C4Cl

InChI

InChI=1S/C31H31ClN6O2/c1-31(2,3)27-19-28(38(36-27)26-15-8-7-14-25(26)32)35-29(39)21-37(17-16-22-10-5-4-6-11-22)30(40)34-24-13-9-12-23(18-24)20-33/h4-15,18-19H,16-17,21H2,1-3H3,(H,34,40)(H,35,39)