N-butyl-4-pyrazin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-pyrazin-2-yl-piperazine-1-carbothioamide Openeye Name: N-butyl-4-pyrazin-2-yl-piperazine-1-carbothioamide CAS Name: N-butyl-4-(2-pyrazinyl)-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-pyrazin-2-ylpiperazine-1-carbothioamide Traditional Name: N-butyl-4-pyrazin-2-yl-piperazine-1-carbothioamide Formula: C13H21N5S MolecularWeight: 279.40434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)C2=NC=CN=C2

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)C2=NC=CN=C2

InChI

InChI=1S/C13H21N5S/c1-2-3-4-16-13(19)18-9-7-17(8-10-18)12-11-14-5-6-15-12/h5-6,11H,2-4,7-10H2,1H3,(H,16,19)