4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-carbothioamide CAS Name: 4-[(1R)-1-(4-methoxyphenyl)ethyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-carbothioamide Traditional Name: 4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-carbothioamide Formula: C14H22N3OS+ MolecularWeight: 280.40898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C(=S)N

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C(=S)N

InChI

InChI=1S/C14H21N3OS/c1-11(12-3-5-13(18-2)6-4-12)16-7-9-17(10-8-16)14(15)19/h3-6,11H,7-10H2,1-2H3,(H2,15,19)/p+1/t11-/m1/s1