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

Systemtic Name: N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-(3-methylbutyl)amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-isopentyl-amino]acetamide CAS Name: N-[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]-2-[[(3-cyanoanilino)-oxomethyl]-(3-methylbutyl)amino]acetamide IUPAC Name: N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-(3-methylbutyl)amino]acetamide Traditional Name: N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoyl-isoamyl-amino]acetamide Formula: C29H36N6O2 MolecularWeight: 500.63514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCC(C)C)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCC(C)C)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C29H36N6O2/c1-20(2)13-14-34(28(37)31-23-11-8-10-22(16-23)18-30)19-27(36)32-26-17-25(29(4,5)6)33-35(26)24-12-7-9-21(3)15-24/h7-12,15-17,20H,13-14,19H2,1-6H3,(H,31,37)(H,32,36)