ethyl 2-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-6-[1-(oxidanylamino)ethylideneamino]hexanoate

Systemtic Name: ethyl 2-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-6-[1-(oxidanylamino)ethylideneamino]hexanoate Openeye Name: ethyl 2-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-6-[1-(hydroxyamino)ethylideneamino]hexanoate CAS Name: 2-[[2-acetamido-4-(methylthio)-1-oxobutyl]amino]-6-[1-(hydroxyamino)ethylideneamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-acetamido-4-methylsulfanylbutanoyl)amino]-6-[1-(hydroxyamino)ethylideneamino]hexanoate Traditional Name: 2-[[2-acetamido-4-(methylthio)butanoyl]amino]-6-[1-(hydroxyamino)ethylideneamino]hexanoic acid ethyl ester Formula: C17H32N4O5S MolecularWeight: 404.52478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCN=C(C)NO)NC(=O)C(CCSC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCCCN=C(C)NO)NC(=O)C(CCSC)NC(=O)C

InChI

InChI=1S/C17H32N4O5S/c1-5-26-17(24)15(8-6-7-10-18-12(2)21-25)20-16(23)14(9-11-27-4)19-13(3)22/h14-15,25H,5-11H2,1-4H3,(H,18,21)(H,19,22)(H,20,23)