2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(isobutyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-(2-methylpropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(isobutyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]acetamide Formula: C34H43N5O3 MolecularWeight: 569.73692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CN(CC(C)C)C(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=C(C=C6)OC

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CN(CC(C)C)C(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=C(C=C6)OC

InChI

InChI=1S/C34H43N5O3/c1-22(2)20-38(33(41)36-34-17-24-14-25(18-34)16-26(15-24)19-34)21-30(40)35-32-31(27-8-6-5-7-9-27)23(3)37-39(32)28-10-12-29(42-4)13-11-28/h5-13,22,24-26H,14-21H2,1-4H3,(H,35,40)(H,36,41)