methyl 6-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-carbamothioyl]amino]hexanoate

Systemtic Name: methyl 6-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-carbamothioyl]amino]hexanoate Openeye Name: methyl 6-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-carbamothioyl]amino]hexanoate CAS Name: 6-[[[(2-methoxy-5-methylphenyl)methyl-methylamino]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(2-methoxy-5-methylphenyl)methyl-methylcarbamothioyl]amino]hexanoate Traditional Name: 6-[[(2-methoxy-5-methyl-benzyl)-methyl-thiocarbamoyl]amino]hexanoic acid methyl ester Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)C(=S)NCCCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)C(=S)NCCCCCC(=O)OC

InChI

InChI=1S/C18H28N2O3S/c1-14-9-10-16(22-3)15(12-14)13-20(2)18(24)19-11-7-5-6-8-17(21)23-4/h9-10,12H,5-8,11,13H2,1-4H3,(H,19,24)