N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(m-tolyl)-4-(4-pyridylmethyl)piperazine-1-carbothioamide CAS Name: N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(m-tolyl)-4-(4-pyridylmethyl)piperazine-1-carbothioamide Formula: C18H22N4S MolecularWeight: 326.45908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H22N4S/c1-15-3-2-4-17(13-15)20-18(23)22-11-9-21(10-12-22)14-16-5-7-19-8-6-16/h2-8,13H,9-12,14H2,1H3,(H,20,23)