2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-N-(cyclohexylmethyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]-N-(cyclohexylmethyl)acetamide IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]-N-(cyclohexylmethyl)acetamide Formula: C17H27BrN3O3S2+ MolecularWeight: 465.44858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CCC(CC1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H26BrN3O3S2/c18-15-6-7-17(25-15)26(23,24)21-10-8-20(9-11-21)13-16(22)19-12-14-4-2-1-3-5-14/h6-7,14H,1-5,8-13H2,(H,19,22)/p+1