N-[3-(dimethylamino)propyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C18H30N4S MolecularWeight: 334.5226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NCCCN(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NCCCN(C)C

InChI

InChI=1S/C18H30N4S/c1-16-7-4-5-8-17(16)15-21-11-13-22(14-12-21)18(23)19-9-6-10-20(2)3/h4-5,7-8H,6,9-15H2,1-3H3,(H,19,23)