3-[[1-(4-tert-butylphenyl)carbonyl-3-[(3-methylphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid

Systemtic Name: 3-[[1-(4-tert-butylphenyl)carbonyl-3-[(3-methylphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[1-(4-tert-butylbenzoyl)-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[1-[(4-tert-butylphenyl)-oxomethyl]-3-[(3-methylanilino)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[1-(4-tert-butylbenzoyl)-3-[(3-methylphenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[[1-(4-tert-butylbenzoyl)-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propionic acid Formula: C32H35FN4O5 MolecularWeight: 574.642503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C32H35FN4O5/c1-20-6-5-7-25(18-20)34-31(42)37-17-16-36(30(41)22-8-12-23(13-9-22)32(2,3)4)29(37)28(40)35-26(19-27(38)39)21-10-14-24(33)15-11-21/h5-15,18,26,29H,16-17,19H2,1-4H3,(H,34,42)(H,35,40)(H,38,39)