2-azanyl-4-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-azanyl-4-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-amino-4-[[2-(carboxymethylamino)-1-(diethylcarbamoylsulfanylmethyl)-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 2-amino-4-[[1-(carboxymethylamino)-3-[[diethylamino(oxo)methyl]thio]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 2-amino-4-[[1-(carboxymethylamino)-3-(diethylcarbamoylsulfanyl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 2-amino-4-[[2-(carboxymethylamino)-1-[(diethylcarbamoylthio)methyl]-2-keto-ethyl]amino]-4-keto-butyric acid Formula: C14H24N4O7S MolecularWeight: 392.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)SCC(C(=O)NCC(=O)O)NC(=O)CC(C(=O)O)N

Isomeric SMILES

CCN(CC)C(=O)SCC(C(=O)NCC(=O)O)NC(=O)CC(C(=O)O)N

InChI

InChI=1S/C14H24N4O7S/c1-3-18(4-2)14(25)26-7-9(12(22)16-6-11(20)21)17-10(19)5-8(15)13(23)24/h8-9H,3-7,15H2,1-2H3,(H,16,22)(H,17,19)(H,20,21)(H,23,24)