N-(2-ethylphenyl)-4-pyridin-4-yl-piperazine-1-carbothioamide

Systemtic Name: N-(2-ethylphenyl)-4-pyridin-4-yl-piperazine-1-carbothioamide Openeye Name: N-(2-ethylphenyl)-4-(4-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-ethylphenyl)-4-pyridin-4-yl-1-piperazinecarbothioamide IUPAC Name: N-(2-ethylphenyl)-4-pyridin-4-ylpiperazine-1-carbothioamide Traditional Name: N-(2-ethylphenyl)-4-(4-pyridyl)piperazine-1-carbothioamide Formula: C18H22N4S MolecularWeight: 326.45908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C18H22N4S/c1-2-15-5-3-4-6-17(15)20-18(23)22-13-11-21(12-14-22)16-7-9-19-10-8-16/h3-10H,2,11-14H2,1H3,(H,20,23)