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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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