methyl 2-[[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]-4-methyl-pentanoate CAS Name: 2-[[[3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]-4-methylpentanoate Traditional Name: 2-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]-4-methyl-valeric acid methyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O4/c1-17(2)13-22(25(30)32-4)26-24(29)21-16-28(15-18-9-6-5-7-10-18)27-23(21)19-11-8-12-20(14-19)31-3/h5-12,14,16-17,22H,13,15H2,1-4H3,(H,26,29)