4-(furan-2-ylmethyl)-N-prop-2-enyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(furan-2-ylmethyl)-N-prop-2-enyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-allyl-4-(2-furylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-(2-furanylmethyl)-N-prop-2-enyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(furan-2-ylmethyl)-N-prop-2-enylpiperazin-4-ium-1-carbothioamide Traditional Name: N-allyl-4-(2-furfuryl)piperazin-4-ium-1-carbothioamide Formula: C13H20N3OS+ MolecularWeight: 266.3824

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1CC[NH+](CC1)CC2=CC=CO2

Isomeric SMILES

C=CCNC(=S)N1CC[NH+](CC1)CC2=CC=CO2

InChI

InChI=1S/C13H19N3OS/c1-2-5-14-13(18)16-8-6-15(7-9-16)11-12-4-3-10-17-12/h2-4,10H,1,5-9,11H2,(H,14,18)/p+1