4-methyl-4-prop-2-enyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-methyl-4-prop-2-enyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-allyl-4-methyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-methyl-4-prop-2-enyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-methyl-4-prop-2-enylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-allyl-4-methyl-piperazin-4-ium-1-carbothioamide Formula: C9H18N3S+ MolecularWeight: 200.32432

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C(=S)N)CC=C

Isomeric SMILES

C[N+]1(CCN(CC1)C(=S)N)CC=C

InChI

InChI=1S/C9H17N3S/c1-3-6-12(2)7-4-11(5-8-12)9(10)13/h3H,1,4-8H2,2H3,(H-,10,13)/p+1