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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CCC1(CCCCCC1)SCC(C(=O)OC)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C17H30N2O5S/c1-3-17(8-6-4-5-7-9-17)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)