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

Systemtic Name: methyl 4-methyl-4-[(4-methyl-3-oxidanyl-4-phenylsulfanyl-pentanoyl)amino]pentanoate Openeye Name: methyl 4-[(3-hydroxy-4-methyl-4-phenylsulfanyl-pentanoyl)amino]-4-methyl-pentanoate CAS Name: 4-[[3-hydroxy-4-methyl-1-oxo-4-(phenylthio)pentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 4-[(3-hydroxy-4-methyl-4-phenylsulfanylpentanoyl)amino]-4-methylpentanoate Traditional Name: 4-[[3-hydroxy-4-methyl-4-(phenylthio)pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H29NO4S MolecularWeight: 367.50286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO4S/c1-18(2,12-11-17(23)24-5)20-16(22)13-15(21)19(3,4)25-14-9-7-6-8-10-14/h6-10,15,21H,11-13H2,1-5H3,(H,20,22)