N-(2,6-diethylphenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(2,6-diethylphenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(2,6-diethylphenyl)-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2,6-diethylphenyl)-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,6-diethylphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(2,6-diethylphenyl)-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C20H26N4S MolecularWeight: 354.51224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C20H26N4S/c1-3-16-8-7-9-17(4-2)19(16)22-20(25)24-14-12-23(13-15-24)18-10-5-6-11-21-18/h5-11H,3-4,12-15H2,1-2H3,(H,22,25)