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

Systemtic Name: 3-azanyl-4-[[3-(1-ethylcyclohexyl)sulfanyl-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[(1-ethylcyclohexyl)sulfanylmethyl]-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[3-[(1-ethylcyclohexyl)thio]-1-methoxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[3-(1-ethylcyclohexyl)sulfanyl-1-methoxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[[(1-ethylcyclohexyl)thio]methyl]-2-keto-2-methoxy-ethyl]amino]-4-keto-butyric acid Formula: C16H28N2O5S MolecularWeight: 360.46892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CCC1(CCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C16H28N2O5S/c1-3-16(7-5-4-6-8-16)24-10-12(15(22)23-2)18-14(21)11(17)9-13(19)20/h11-12H,3-10,17H2,1-2H3,(H,18,21)(H,19,20)