ethyl N-[4-[(6-chloranylpyridin-2-yl)methyl]piperazin-1-yl]carbothioylcarbamate

Systemtic Name: ethyl N-[4-[(6-chloranylpyridin-2-yl)methyl]piperazin-1-yl]carbothioylcarbamate Openeye Name: ethyl N-[4-[(6-chloro-2-pyridyl)methyl]piperazine-1-carbothioyl]carbamate CAS Name: N-[[4-[(6-chloro-2-pyridinyl)methyl]-1-piperazinyl]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[(6-chloropyridin-2-yl)methyl]piperazine-1-carbothioyl]carbamate Traditional Name: N-[4-[(6-chloro-2-pyridyl)methyl]piperazine-1-carbothioyl]carbamic acid ethyl ester Formula: C14H19ClN4O2S MolecularWeight: 342.84426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)N1CCN(CC1)CC2=NC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)NC(=S)N1CCN(CC1)CC2=NC(=CC=C2)Cl

InChI

InChI=1S/C14H19ClN4O2S/c1-2-21-14(20)17-13(22)19-8-6-18(7-9-19)10-11-4-3-5-12(15)16-11/h3-5H,2,6-10H2,1H3,(H,17,20,22)