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

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[(2-methoxy-5-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-(2-methoxy-5-methyl-benzyl)piperazine-1-carbothioamide Formula: C19H32N4OS MolecularWeight: 364.54858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4OS/c1-16-6-7-18(24-4)17(14-16)15-22-10-12-23(13-11-22)19(25)20-8-5-9-21(2)3/h6-7,14H,5,8-13,15H2,1-4H3,(H,20,25)