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

Systemtic Name: 2-[(5-azanyl-2-tert-butylsulfanyl-pentanoyl)amino]-4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]pentanamide Openeye Name: 2-[(5-amino-2-tert-butylsulfanyl-pentanoyl)amino]-N-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-4-methyl-pentanamide CAS Name: 2-[[5-amino-2-(tert-butylthio)-1-oxopentyl]amino]-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide IUPAC Name: 2-[(5-amino-2-tert-butylsulfanylpentanoyl)amino]-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide Traditional Name: 2-[[5-amino-2-(tert-butylthio)pentanoyl]amino]-N-[1-benzyl-2-keto-2-(methylamino)ethyl]-4-methyl-valeramide Formula: C25H42N4O3S MolecularWeight: 478.69098

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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(CCCN)SC(C)(C)C

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=O)C(CCCN)SC(C)(C)C

InChI

InChI=1S/C25H42N4O3S/c1-17(2)15-19(29-24(32)21(13-10-14-26)33-25(3,4)5)23(31)28-20(22(30)27-6)16-18-11-8-7-9-12-18/h7-9,11-12,17,19-21H,10,13-16,26H2,1-6H3,(H,27,30)(H,28,31)(H,29,32)