2-azanyl-5-[[2-(carboxymethylamino)-1-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[2-(carboxymethylamino)-1-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[2-(carboxymethylamino)-1-(1-methyl-4-nitrososulfanyl-4-piperidyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[2-(carboxymethylamino)-1-[1-methyl-4-(nitrosothio)-4-piperidinyl]-2-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[2-(carboxymethylamino)-1-(1-methyl-4-nitrososulfanylpiperidin-4-yl)-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[2-(carboxymethylamino)-2-keto-1-[1-methyl-4-(nitrosothio)-4-piperidyl]ethyl]amino]-5-keto-valeric acid Formula: C15H25N5O7S MolecularWeight: 419.4533

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)SN=O

Isomeric SMILES

CN1CCC(CC1)(C(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)SN=O

InChI

InChI=1S/C15H25N5O7S/c1-20-6-4-15(5-7-20,28-19-27)12(13(24)17-8-11(22)23)18-10(21)3-2-9(16)14(25)26/h9,12H,2-8,16H2,1H3,(H,17,24)(H,18,21)(H,22,23)(H,25,26)