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

Systemtic Name: 3-azanyl-4-[(1-methoxy-1-oxidanylidene-3-sulfanyl-propan-2-yl)-(2-propan-2-ylcyclohexyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[(2-isopropylcyclohexyl)-[2-methoxy-2-oxo-1-(sulfanylmethyl)ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[(3-mercapto-1-methoxy-1-oxopropan-2-yl)-(2-propan-2-ylcyclohexyl)amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[(1-methoxy-1-oxo-3-sulfanylpropan-2-yl)-(2-propan-2-ylcyclohexyl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[(2-isopropylcyclohexyl)-[2-keto-1-(mercaptomethyl)-2-methoxy-ethyl]amino]-4-keto-butyric acid Formula: C17H30N2O5S MolecularWeight: 374.4955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCCCC1N(C(CS)C(=O)OC)C(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)C1CCCCC1N(C(CS)C(=O)OC)C(=O)C(CC(=O)O)N

InChI

InChI=1S/C17H30N2O5S/c1-10(2)11-6-4-5-7-13(11)19(14(9-25)17(23)24-3)16(22)12(18)8-15(20)21/h10-14,25H,4-9,18H2,1-3H3,(H,20,21)