N-(1,3-benzodioxol-5-ylmethyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(2-pyrazinyl)-1-piperazinecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-pyrazin-2-ylpiperazine-1-carbothioamide Traditional Name: N-piperonyl-4-pyrazin-2-yl-piperazine-1-carbothioamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19N5O2S/c25-17(20-10-13-1-2-14-15(9-13)24-12-23-14)22-7-5-21(6-8-22)16-11-18-3-4-19-16/h1-4,9,11H,5-8,10,12H2,(H,20,25)