methyl 6-[(2-ethoxyphenyl)carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[(2-ethoxyphenyl)carbamothioylamino]hexanoate Openeye Name: methyl 6-[(2-ethoxyphenyl)carbamothioylamino]hexanoate CAS Name: 6-[[(2-ethoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-ethoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 6-(o-phenetylthiocarbamoylamino)hexanoic acid methyl ester Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NCCCCCC(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NCCCCCC(=O)OC

InChI

InChI=1S/C16H24N2O3S/c1-3-21-14-10-7-6-9-13(14)18-16(22)17-12-8-4-5-11-15(19)20-2/h6-7,9-10H,3-5,8,11-12H2,1-2H3,(H2,17,18,22)