N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide

Systemtic Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Openeye Name: N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide CAS Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)-1-adamantanecarboxamide IUPAC Name: N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Traditional Name: N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Formula: C31H44N4O3 MolecularWeight: 520.70606

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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)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCCOC)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C31H44N4O3/c1-21-8-6-9-25(12-21)35-27(16-26(33-35)30(2,3)4)32-28(36)20-34(10-7-11-38-5)29(37)31-17-22-13-23(18-31)15-24(14-22)19-31/h6,8-9,12,16,22-24H,7,10-11,13-15,17-20H2,1-5H3,(H,32,36)