methyl 4-methyl-4-[[4-methyl-4-[(4-methyl-3-oxidanyl-4-phenylsulfanyl-pentanoyl)amino]pentanoyl]amino]pentanoate

Systemtic Name: methyl 4-methyl-4-[[4-methyl-4-[(4-methyl-3-oxidanyl-4-phenylsulfanyl-pentanoyl)amino]pentanoyl]amino]pentanoate Openeye Name: methyl 4-[[4-[(3-hydroxy-4-methyl-4-phenylsulfanyl-pentanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoate CAS Name: 4-[[4-[[3-hydroxy-4-methyl-1-oxo-4-(phenylthio)pentyl]amino]-4-methyl-1-oxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 4-[[4-[(3-hydroxy-4-methyl-4-phenylsulfanylpentanoyl)amino]-4-methylpentanoyl]amino]-4-methylpentanoate Traditional Name: 4-[[4-[[3-hydroxy-4-methyl-4-(phenylthio)pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C25H40N2O5S MolecularWeight: 480.6605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)NC(C)(C)CCC(=O)OC)NC(=O)CC(C(C)(C)SC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(CCC(=O)NC(C)(C)CCC(=O)OC)NC(=O)CC(C(C)(C)SC1=CC=CC=C1)O

InChI

InChI=1S/C25H40N2O5S/c1-23(2,15-13-20(29)26-24(3,4)16-14-22(31)32-7)27-21(30)17-19(28)25(5,6)33-18-11-9-8-10-12-18/h8-12,19,28H,13-17H2,1-7H3,(H,26,29)(H,27,30)