3-[[1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-(3-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-cyclohexyl-propanoic acid

Systemtic Name: 3-[[1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-(3-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-cyclohexyl-propanoic acid Openeye Name: 3-[[1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[[1-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-3-[(3-methylphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[[1-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-m-toluoyl-imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C30H41N5O5 MolecularWeight: 551.67704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC(=NN4C)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC(=NN4C)C(C)(C)C

InChI

InChI=1S/C30H41N5O5/c1-19-10-9-13-21(16-19)28(39)34-14-15-35(29(40)23-18-24(30(2,3)4)32-33(23)5)27(34)26(38)31-22(17-25(36)37)20-11-7-6-8-12-20/h9-10,13,16,18,20,22,27H,6-8,11-12,14-15,17H2,1-5H3,(H,31,38)(H,36,37)