N-(2-diethylaminoethyl)-4-(2-pyridin-4-ylethyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-diethylaminoethyl)-4-(2-pyridin-4-ylethyl)piperazine-1-carbothioamide Openeye Name: N-(2-diethylaminoethyl)-4-[2-(4-pyridyl)ethyl]piperazine-1-carbothioamide CAS Name: N-(2-diethylaminoethyl)-4-(2-pyridin-4-ylethyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-diethylaminoethyl)-4-(2-pyridin-4-ylethyl)piperazine-1-carbothioamide Traditional Name: N-(2-diethylaminoethyl)-4-[2-(4-pyridyl)ethyl]piperazine-1-carbothioamide Formula: C18H31N5S MolecularWeight: 349.53724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=S)N1CCN(CC1)CCC2=CC=NC=C2

Isomeric SMILES

CCN(CC)CCNC(=S)N1CCN(CC1)CCC2=CC=NC=C2

InChI

InChI=1S/C18H31N5S/c1-3-21(4-2)12-10-20-18(24)23-15-13-22(14-16-23)11-7-17-5-8-19-9-6-17/h5-6,8-9H,3-4,7,10-16H2,1-2H3,(H,20,24)