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

Systemtic Name: N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]-2-[3-methoxypropyl-[(phenylmethyl)carbamoyl]amino]ethanamide Openeye Name: 2-[benzylcarbamoyl(3-methoxypropyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]-2-[3-methoxypropyl-[oxo-[(phenylmethyl)amino]methyl]amino]acetamide IUPAC Name: 2-[benzylcarbamoyl(3-methoxypropyl)amino]-N-[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzylcarbamoyl(3-methoxypropyl)amino]-N-[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]acetamide Formula: C28H37N5O3 MolecularWeight: 491.62508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N5O3/c1-21-11-9-14-23(17-21)33-25(18-24(31-33)28(2,3)4)30-26(34)20-32(15-10-16-36-5)27(35)29-19-22-12-7-6-8-13-22/h6-9,11-14,17-18H,10,15-16,19-20H2,1-5H3,(H,29,35)(H,30,34)