2-acetamido-N-[4-[[(2-acetamido-3-methyl-butanoyl)amino]-[(4-fluorophenyl)methyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-butanamide

Systemtic Name: 2-acetamido-N-[4-[[(2-acetamido-3-methyl-butanoyl)amino]-[(4-fluorophenyl)methyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-butanamide Openeye Name: 2-acetamido-N-[3-[[(2-acetamido-3-methyl-butanoyl)amino]-[(4-fluorophenyl)methyl]amino]-1-benzyl-2-hydroxy-propyl]-3-methyl-butanamide CAS Name: 2-acetamido-N-[4-[[(2-acetamido-3-methyl-1-oxobutyl)amino]-[(4-fluorophenyl)methyl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methylbutanamide IUPAC Name: 2-acetamido-N-[4-[[(2-acetamido-3-methylbutanoyl)amino]-[(4-fluorophenyl)methyl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methylbutanamide Traditional Name: 2-acetamido-N-[3-[[(2-acetamido-3-methyl-butanoyl)amino]-(4-fluorobenzyl)amino]-1-benzyl-2-hydroxy-propyl]-3-methyl-butyramide Formula: C31H44FN5O5 MolecularWeight: 585.709963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC2=CC=C(C=C2)F)NC(=O)C(C(C)C)NC(=O)C)O)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC2=CC=C(C=C2)F)NC(=O)C(C(C)C)NC(=O)C)O)NC(=O)C

InChI

InChI=1S/C31H44FN5O5/c1-19(2)28(33-21(5)38)30(41)35-26(16-23-10-8-7-9-11-23)27(40)18-37(17-24-12-14-25(32)15-13-24)36-31(42)29(20(3)4)34-22(6)39/h7-15,19-20,26-29,40H,16-18H2,1-6H3,(H,33,38)(H,34,39)(H,35,41)(H,36,42)