N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[2-chloranylethanoyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[2-chloranylethanoyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-(2-chloroacetyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]-2-[(2-chloro-1-oxoethyl)-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-(2-chloroacetyl)amino]-N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzyl-(2-chloroacetyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide Formula: C25H29ClN4O2 MolecularWeight: 452.97636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)CCl

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)CCl

InChI

InChI=1S/C25H29ClN4O2/c1-18-9-8-12-20(13-18)30-22(14-21(28-30)25(2,3)4)27-23(31)17-29(24(32)15-26)16-19-10-6-5-7-11-19/h5-14H,15-17H2,1-4H3,(H,27,31)