N-(2-ethylhexyl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-ethylhexyl)-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(2-ethylhexyl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(2-ethylhexyl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(2-ethylhexyl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(2-ethylhexyl)-4-methyl-piperazine-1-carbothioamide Formula: C14H29N3S MolecularWeight: 271.46516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)N1CCN(CC1)C

Isomeric SMILES

CCCCC(CC)CNC(=S)N1CCN(CC1)C

InChI

InChI=1S/C14H29N3S/c1-4-6-7-13(5-2)12-15-14(18)17-10-8-16(3)9-11-17/h13H,4-12H2,1-3H3,(H,15,18)