tert-butyl 2-[(4-methyl-2-phenyl-pentanoyl)-(methylsulfonylamino)amino]-5-phenyl-pentanoate

Systemtic Name: tert-butyl 2-[(4-methyl-2-phenyl-pentanoyl)-(methylsulfonylamino)amino]-5-phenyl-pentanoate Openeye Name: tert-butyl 2-[methanesulfonamido-(4-methyl-2-phenyl-pentanoyl)amino]-5-phenyl-pentanoate CAS Name: 2-[methanesulfonamido-(4-methyl-1-oxo-2-phenylpentyl)amino]-5-phenylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[methanesulfonamido-(4-methyl-2-phenylpentanoyl)amino]-5-phenylpentanoate Traditional Name: 2-[methanesulfonamido-(4-methyl-2-phenyl-pentanoyl)amino]-5-phenyl-valeric acid tert-butyl ester Formula: C28H40N2O5S MolecularWeight: 516.6926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)C(=O)N(C(CCCC2=CC=CC=C2)C(=O)OC(C)(C)C)NS(=O)(=O)C

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)C(=O)N(C(CCCC2=CC=CC=C2)C(=O)OC(C)(C)C)NS(=O)(=O)C

InChI

InChI=1S/C28H40N2O5S/c1-21(2)20-24(23-17-11-8-12-18-23)26(31)30(29-36(6,33)34)25(27(32)35-28(3,4)5)19-13-16-22-14-9-7-10-15-22/h7-12,14-15,17-18,21,24-25,29H,13,16,19-20H2,1-6H3