[2-[(3-methoxy-4-methyl-phenyl)methylcarbamothioyloxymethyl]-3-phenyl-propyl] 2,2-dimethylpropanoate

Systemtic Name: [2-[(3-methoxy-4-methyl-phenyl)methylcarbamothioyloxymethyl]-3-phenyl-propyl] 2,2-dimethylpropanoate Openeye Name: [2-benzyl-3-[(3-methoxy-4-methyl-phenyl)methylcarbamothioyloxy]propyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-[[[(3-methoxy-4-methylphenyl)methylamino]-sulfanylidenemethoxy]methyl]-3-phenylpropyl] ester IUPAC Name: [2-benzyl-3-[(3-methoxy-4-methylphenyl)methylcarbamothioyloxy]propyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-benzyl-3-[(3-methoxy-4-methyl-benzyl)thiocarbamoyloxy]propyl] ester Formula: C25H33NO4S MolecularWeight: 443.59882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=S)OCC(CC2=CC=CC=C2)COC(=O)C(C)(C)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=S)OCC(CC2=CC=CC=C2)COC(=O)C(C)(C)C)OC

InChI

InChI=1S/C25H33NO4S/c1-18-11-12-20(14-22(18)28-5)15-26-24(31)30-17-21(13-19-9-7-6-8-10-19)16-29-23(27)25(2,3)4/h6-12,14,21H,13,15-17H2,1-5H3,(H,26,31)