3-azanyl-4-[(1-methoxy-1-oxidanylidene-3-sulfanyl-propan-2-yl)-(3-methylcyclohexyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[(1-methoxy-1-oxidanylidene-3-sulfanyl-propan-2-yl)-(3-methylcyclohexyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-methoxy-2-oxo-1-(sulfanylmethyl)ethyl]-(3-methylcyclohexyl)amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[(3-mercapto-1-methoxy-1-oxopropan-2-yl)-(3-methylcyclohexyl)amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[(1-methoxy-1-oxo-3-sulfanylpropan-2-yl)-(3-methylcyclohexyl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-keto-4-[[2-keto-1-(mercaptomethyl)-2-methoxy-ethyl]-(3-methylcyclohexyl)amino]butyric acid Formula: C15H26N2O5S MolecularWeight: 346.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)N(C(CS)C(=O)OC)C(=O)C(CC(=O)O)N

Isomeric SMILES

CC1CCCC(C1)N(C(CS)C(=O)OC)C(=O)C(CC(=O)O)N

InChI

InChI=1S/C15H26N2O5S/c1-9-4-3-5-10(6-9)17(12(8-23)15(21)22-2)14(20)11(16)7-13(18)19/h9-12,23H,3-8,16H2,1-2H3,(H,18,19)