2-acetamido-N-[4-[ethanoyl-(4-methyl-2-oxidanylidene-1-thiophen-2-yl-pentan-3-yl)amino]-1-phenyl-butyl]-3-methyl-2-oxidanyl-butanamide

Systemtic Name: 2-acetamido-N-[4-[ethanoyl-(4-methyl-2-oxidanylidene-1-thiophen-2-yl-pentan-3-yl)amino]-1-phenyl-butyl]-3-methyl-2-oxidanyl-butanamide Openeye Name: 2-acetamido-N-[4-[acetyl-[1-isopropyl-2-oxo-3-(2-thienyl)propyl]amino]-1-phenyl-butyl]-2-hydroxy-3-methyl-butanamide CAS Name: 2-acetamido-N-[4-[acetyl-(4-methyl-2-oxo-1-thiophen-2-ylpentan-3-yl)amino]-1-phenylbutyl]-2-hydroxy-3-methylbutanamide IUPAC Name: 2-acetamido-N-[4-[acetyl-(4-methyl-2-oxo-1-thiophen-2-ylpentan-3-yl)amino]-1-phenylbutyl]-2-hydroxy-3-methylbutanamide Traditional Name: 2-acetamido-N-[4-[acetyl-[1-isopropyl-2-keto-3-(2-thienyl)propyl]amino]-1-phenyl-butyl]-2-hydroxy-3-methyl-butyramide Formula: C29H41N3O5S MolecularWeight: 543.71794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CC1=CC=CS1)N(CCCC(C2=CC=CC=C2)NC(=O)C(C(C)C)(NC(=O)C)O)C(=O)C

Isomeric SMILES

CC(C)C(C(=O)CC1=CC=CS1)N(CCCC(C2=CC=CC=C2)NC(=O)C(C(C)C)(NC(=O)C)O)C(=O)C

InChI

InChI=1S/C29H41N3O5S/c1-19(2)27(26(35)18-24-14-11-17-38-24)32(22(6)34)16-10-15-25(23-12-8-7-9-13-23)30-28(36)29(37,20(3)4)31-21(5)33/h7-9,11-14,17,19-20,25,27,37H,10,15-16,18H2,1-6H3,(H,30,36)(H,31,33)