methyl 6-[[(2-hydroxyphenyl)carbonylamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(2-hydroxyphenyl)carbonylamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(2-hydroxybenzoyl)amino]carbamothioylamino]hexanoate CAS Name: 6-[[[[(2-hydroxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(2-hydroxybenzoyl)amino]carbamothioylamino]hexanoate Traditional Name: 6-[(salicyloylamino)thiocarbamoylamino]hexanoic acid methyl ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=S)NNC(=O)C1=CC=CC=C1O

Isomeric SMILES

COC(=O)CCCCCNC(=S)NNC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C15H21N3O4S/c1-22-13(20)9-3-2-6-10-16-15(23)18-17-14(21)11-7-4-5-8-12(11)19/h4-5,7-8,19H,2-3,6,9-10H2,1H3,(H,17,21)(H2,16,18,23)