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

Systemtic Name: methyl 6-[(3,4-dimethoxyphenyl)carbamothioylamino]hexanoate Openeye Name: methyl 6-[(3,4-dimethoxyphenyl)carbamothioylamino]hexanoate CAS Name: 6-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(3,4-dimethoxyphenyl)carbamothioylamino]hexanoate Traditional Name: 6-[(3,4-dimethoxyphenyl)thiocarbamoylamino]hexanoic acid methyl ester Formula: C16H24N2O4S MolecularWeight: 340.43776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NCCCCCC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NCCCCCC(=O)OC)OC

InChI

InChI=1S/C16H24N2O4S/c1-20-13-9-8-12(11-14(13)21-2)18-16(23)17-10-6-4-5-7-15(19)22-3/h8-9,11H,4-7,10H2,1-3H3,(H2,17,18,23)