(3S)-3-azanyl-4-[[(2R)-1-[(2,4-dimethyl-2-methylsulfanyl-pentan-3-yl)amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[(2R)-1-[(2,4-dimethyl-2-methylsulfanyl-pentan-3-yl)amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[[(1R)-2-[(1-isopropyl-2-methyl-2-methylsulfanyl-propyl)amino]-1-methyl-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[[(2R)-1-[[2,4-dimethyl-2-(methylthio)pentan-3-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[[(2R)-1-[(2,4-dimethyl-2-methylsulfanylpentan-3-yl)amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-[[(1R)-2-[[1-isopropyl-2-methyl-2-(methylthio)propyl]amino]-2-keto-1-methyl-ethyl]amino]-4-keto-butyric acid Formula: C15H29N3O4S MolecularWeight: 347.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)(C)SC)NC(=O)C(C)NC(=O)C(CC(=O)O)N

Isomeric SMILES

C[C@H](C(=O)NC(C(C)C)C(C)(C)SC)NC(=O)[C@H](CC(=O)O)N

InChI

InChI=1S/C15H29N3O4S/c1-8(2)12(15(4,5)23-6)18-13(21)9(3)17-14(22)10(16)7-11(19)20/h8-10,12H,7,16H2,1-6H3,(H,17,22)(H,18,21)(H,19,20)/t9-,10+,12?/m1/s1