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

Systemtic Name: 2-[(3-bromophenyl)carbamoyl-(3-methylbutyl)amino]-N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[(3-bromophenyl)carbamoyl-isopentyl-amino]-N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]acetamide CAS Name: 2-[[(3-bromoanilino)-oxomethyl]-(3-methylbutyl)amino]-N-[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[(3-bromophenyl)carbamoyl-(3-methylbutyl)amino]-N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[(3-bromophenyl)carbamoyl-isoamyl-amino]-N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]acetamide Formula: C28H36BrN5O2 MolecularWeight: 554.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCC(C)C)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCC(C)C)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C28H36BrN5O2/c1-19(2)14-15-33(27(36)30-22-12-9-11-21(29)16-22)18-26(35)31-25-17-24(28(4,5)6)32-34(25)23-13-8-7-10-20(23)3/h7-13,16-17,19H,14-15,18H2,1-6H3,(H,30,36)(H,31,35)