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

Systemtic Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-propan-2-ylamino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]acetamide Formula: C33H41N5O3 MolecularWeight: 555.71034

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H41N5O3/c1-21(2)37(32(40)35-33-17-23-14-24(18-33)16-25(15-23)19-33)20-29(39)34-31-30(26-8-6-5-7-9-26)22(3)36-38(31)27-10-12-28(41-4)13-11-27/h5-13,21,23-25H,14-20H2,1-4H3,(H,34,39)(H,35,40)