2-azanyl-5-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[1-[(carboxymethylamino)methyl]-2-(diethylcarbamoylsulfanyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[1-(carboxymethylamino)-3-[[diethylamino(oxo)methyl]thio]propan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)propan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[1-[(carboxymethylamino)methyl]-2-(diethylcarbamoylthio)ethyl]amino]-5-keto-valeric acid Formula: C15H28N4O6S MolecularWeight: 392.47102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)SCC(CNCC(=O)O)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCN(CC)C(=O)SCC(CNCC(=O)O)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C15H28N4O6S/c1-3-19(4-2)15(25)26-9-10(7-17-8-13(21)22)18-12(20)6-5-11(16)14(23)24/h10-11,17H,3-9,16H2,1-2H3,(H,18,20)(H,21,22)(H,23,24)