2-azanyl-5-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-nitrososulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-nitrososulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[2-[(2-ethoxy-2-oxo-ethyl)amino]-1-(nitrososulfanylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[1-[(2-ethoxy-2-oxoethyl)amino]-3-(nitrosothio)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[1-[(2-ethoxy-2-oxoethyl)amino]-3-nitrososulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[2-[(2-ethoxy-2-keto-ethyl)amino]-2-keto-1-[(nitrosothio)methyl]ethyl]amino]-5-keto-valeric acid Formula: C12H20N4O7S MolecularWeight: 364.3748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CSN=O)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)CNC(=O)C(CSN=O)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C12H20N4O7S/c1-2-23-10(18)5-14-11(19)8(6-24-16-22)15-9(17)4-3-7(13)12(20)21/h7-8H,2-6,13H2,1H3,(H,14,19)(H,15,17)(H,20,21)