4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[[5-(methylsulfonylamino)-2-sulfanyl-pentanoyl]amino]pentanamide

Systemtic Name: 4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[[5-(methylsulfonylamino)-2-sulfanyl-pentanoyl]amino]pentanamide Openeye Name: N-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-2-[[5-(methanesulfonamido)-2-sulfanyl-pentanoyl]amino]-4-methyl-pentanamide CAS Name: 2-[[2-mercapto-5-(methanesulfonamido)-1-oxopentyl]amino]-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide IUPAC Name: 2-[[5-(methanesulfonamido)-2-sulfanylpentanoyl]amino]-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide Traditional Name: N-[1-benzyl-2-keto-2-(methylamino)ethyl]-2-[[2-mercapto-5-(methanesulfonamido)pentanoyl]amino]-4-methyl-valeramide Formula: C22H36N4O5S2 MolecularWeight: 500.67504

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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(CCCNS(=O)(=O)C)S

Isomeric SMILES

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

InChI

InChI=1S/C22H36N4O5S2/c1-15(2)13-17(26-22(29)19(32)11-8-12-24-33(4,30)31)21(28)25-18(20(27)23-3)14-16-9-6-5-7-10-16/h5-7,9-10,15,17-19,24,32H,8,11-14H2,1-4H3,(H,23,27)(H,25,28)(H,26,29)