2-ethanoyl-N-[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]-4-oxidanylidene-2-sulfanyl-pentanamide

Systemtic Name: 2-ethanoyl-N-[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]-4-oxidanylidene-2-sulfanyl-pentanamide Openeye Name: 2-acetyl-N-[1-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]-4-oxo-2-sulfanyl-pentanamide CAS Name: 2-acetyl-2-mercapto-N-[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]-4-oxopentanamide IUPAC Name: 2-acetyl-N-[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]-4-oxo-2-sulfanylpentanamide Traditional Name: 2-acetyl-N-[1-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-3-methyl-butyl]-4-keto-2-mercapto-valeramide Formula: C23H33N3O5S MolecularWeight: 463.59022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=O)C(CC(=O)C)(C(=O)C)S

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=O)C(CC(=O)C)(C(=O)C)S

InChI

InChI=1S/C23H33N3O5S/c1-14(2)11-18(26-22(31)23(32,16(4)28)13-15(3)27)21(30)25-19(20(29)24-5)12-17-9-7-6-8-10-17/h6-10,14,18-19,32H,11-13H2,1-5H3,(H,24,29)(H,25,30)(H,26,31)