N-(4-bromophenyl)-4-cyclohexyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(4-bromophenyl)-4-cyclohexyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-(4-bromophenyl)-4-cyclohexyl-piperazin-4-ium-1-carbothioamide CAS Name: N-(4-bromophenyl)-4-cyclohexyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(4-bromophenyl)-4-cyclohexylpiperazin-4-ium-1-carbothioamide Traditional Name: N-(4-bromophenyl)-4-cyclohexyl-piperazin-4-ium-1-carbothioamide Formula: C17H25BrN3S+ MolecularWeight: 383.3695

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H24BrN3S/c18-14-6-8-15(9-7-14)19-17(22)21-12-10-20(11-13-21)16-4-2-1-3-5-16/h6-9,16H,1-5,10-13H2,(H,19,22)/p+1