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

Systemtic Name: N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[(phenylmethyl)carbamoyl-propan-2-yl-amino]ethanamide Openeye Name: 2-[benzylcarbamoyl(isopropyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]-2-[[oxo-[(phenylmethyl)amino]methyl]-propan-2-ylamino]acetamide IUPAC Name: 2-[benzylcarbamoyl(propan-2-yl)amino]-N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzylcarbamoyl(isopropyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(C(C)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(C(C)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H35N5O2/c1-19(2)31(26(34)28-17-21-12-8-7-9-13-21)18-25(33)29-24-16-23(27(4,5)6)30-32(24)22-14-10-11-20(3)15-22/h7-16,19H,17-18H2,1-6H3,(H,28,34)(H,29,33)