N-phenethyl-4-pyridin-4-yl-piperazine-1-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H22N4S/c23-18(20-11-6-16-4-2-1-3-5-16)22-14-12-21(13-15-22)17-7-9-19-10-8-17/h1-5,7-10H,6,11-15H2,(H,20,23)