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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CCCC1(CCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C17H30N2O5S/c1-3-7-17(8-5-4-6-9-17)25-11-13(16(23)24-2)19-15(22)12(18)10-14(20)21/h12-13H,3-11,18H2,1-2H3,(H,19,22)(H,20,21)