N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-[3-methylbutyl-[(phenylmethyl)carbamoyl]amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-[3-methylbutyl-[(phenylmethyl)carbamoyl]amino]ethanamide Openeye Name: 2-[benzylcarbamoyl(isopentyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]-2-[3-methylbutyl-[oxo-[(phenylmethyl)amino]methyl]amino]acetamide IUPAC Name: 2-[benzylcarbamoyl(3-methylbutyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzylcarbamoyl(isoamyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Formula: C29H39N5O3 MolecularWeight: 505.65166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C29H39N5O3/c1-21(2)16-17-33(28(36)30-19-22-10-8-7-9-11-22)20-27(35)31-26-18-25(29(3,4)5)32-34(26)23-12-14-24(37-6)15-13-23/h7-15,18,21H,16-17,19-20H2,1-6H3,(H,30,36)(H,31,35)