2-azanyl-3-[[1-(2-cyclohexylethanoyl)pyrrolidin-2-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[[1-(2-cyclohexylethanoyl)pyrrolidin-2-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[[1-(2-cyclohexylacetyl)pyrrolidin-2-yl]methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[[1-(2-cyclohexyl-1-oxoethyl)-2-pyrrolidinyl]methylthio]propanoic acid IUPAC Name: 2-amino-3-[[1-(2-cyclohexylacetyl)pyrrolidin-2-yl]methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[[1-(2-cyclohexylacetyl)pyrrolidin-2-yl]methylthio]propionic acid Formula: C16H28N2O3S MolecularWeight: 328.47012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)N2CCCC2CSCC(C(=O)O)N

Isomeric SMILES

C1CCC(CC1)CC(=O)N2CCCC2CSCC(C(=O)O)N

InChI

InChI=1S/C16H28N2O3S/c17-14(16(20)21)11-22-10-13-7-4-8-18(13)15(19)9-12-5-2-1-3-6-12/h12-14H,1-11,17H2,(H,20,21)