methyl 6-[(4-methoxyphenyl)methylcarbamothioylamino]hexanoate

Systemtic Name: methyl 6-[(4-methoxyphenyl)methylcarbamothioylamino]hexanoate Openeye Name: methyl 6-[(4-methoxyphenyl)methylcarbamothioylamino]hexanoate CAS Name: 6-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-methoxyphenyl)methylcarbamothioylamino]hexanoate Traditional Name: 6-(p-anisylthiocarbamoylamino)hexanoic acid methyl ester Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NCCCCCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NCCCCCC(=O)OC

InChI

InChI=1S/C16H24N2O3S/c1-20-14-9-7-13(8-10-14)12-18-16(22)17-11-5-3-4-6-15(19)21-2/h7-10H,3-6,11-12H2,1-2H3,(H2,17,18,22)