N-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-4-methyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-4-methyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-methyl-N-[(1R,2R,4S)-norbornan-2-yl]piperazin-4-ium-1-carbothioamide CAS Name: N-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-4-methyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-4-methylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-methyl-N-[(1R,2R,4S)-norbornan-2-yl]piperazin-4-ium-1-carbothioamide Formula: C13H24N3S+ MolecularWeight: 254.41476

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)NC2CC3CCC2C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)N[C@@H]2C[C@H]3CC[C@@H]2C3

InChI

InChI=1S/C13H23N3S/c1-15-4-6-16(7-5-15)13(17)14-12-9-10-2-3-11(12)8-10/h10-12H,2-9H2,1H3,(H,14,17)/p+1/t10-,11+,12+/m0/s1