4-[(2,5-dimethoxyphenyl)methyl]-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-[(2,5-dimethoxyphenyl)methyl]-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-[(2,5-dimethoxyphenyl)methyl]-N-methyl-piperazine-1-carbothioamide CAS Name: 4-[(2,5-dimethoxyphenyl)methyl]-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-[(2,5-dimethoxyphenyl)methyl]-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(2,5-dimethoxybenzyl)-N-methyl-piperazine-1-carbothioamide Formula: C15H23N3O2S MolecularWeight: 309.42702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN(CC1)CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CNC(=S)N1CCN(CC1)CC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C15H23N3O2S/c1-16-15(21)18-8-6-17(7-9-18)11-12-10-13(19-2)4-5-14(12)20-3/h4-5,10H,6-9,11H2,1-3H3,(H,16,21)