4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Openeye Name: 4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide CAS Name: 4-[(2-methoxy-5-methylphenyl)methyl]-N-[3-(methylthio)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(2-methoxy-5-methylphenyl)methyl]-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(2-methoxy-5-methyl-benzyl)-N-[3-(methylthio)propyl]piperazine-1-carbothioamide Formula: C18H29N3OS2 MolecularWeight: 367.57236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=S)NCCCSC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=S)NCCCSC

InChI

InChI=1S/C18H29N3OS2/c1-15-5-6-17(22-2)16(13-15)14-20-8-10-21(11-9-20)18(23)19-7-4-12-24-3/h5-6,13H,4,7-12,14H2,1-3H3,(H,19,23)