N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-(2-chloranylpropanoylamino)-3-phenyl-propanamide

Systemtic Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-(2-chloranylpropanoylamino)-3-phenyl-propanamide Openeye Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-(2-chloropropanoylamino)-3-phenyl-propanamide CAS Name: N-[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]-2-[(2-chloro-1-oxopropyl)amino]-3-phenylpropanamide IUPAC Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-(2-chloropropanoylamino)-3-phenylpropanamide Traditional Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-(2-chloropropanoylamino)-3-phenyl-propionamide Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(C)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(C)Cl

InChI

InChI=1S/C26H31ClN4O2/c1-17-11-9-10-14-21(17)31-23(16-22(30-31)26(3,4)5)29-25(33)20(28-24(32)18(2)27)15-19-12-7-6-8-13-19/h6-14,16,18,20H,15H2,1-5H3,(H,28,32)(H,29,33)