methyl 6-[(3,4,5-trimethoxyphenyl)carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[(3,4,5-trimethoxyphenyl)carbamothioylamino]hexanoate Openeye Name: methyl 6-[(3,4,5-trimethoxyphenyl)carbamothioylamino]hexanoate CAS Name: 6-[[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(3,4,5-trimethoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 6-[(3,4,5-trimethoxyphenyl)thiocarbamoylamino]hexanoic acid methyl ester Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NCCCCCC(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NCCCCCC(=O)OC

InChI

InChI=1S/C17H26N2O5S/c1-21-13-10-12(11-14(22-2)16(13)24-4)19-17(25)18-9-7-5-6-8-15(20)23-3/h10-11H,5-9H2,1-4H3,(H2,18,19,25)