2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide

Systemtic Name: 2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide Openeye Name: 2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide CAS Name: 2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[(cyclohexylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Traditional Name: 2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Formula: C18H29ClN4O2S+2 MolecularWeight: 400.96646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H27ClN4O2S/c19-16-7-6-15(26-16)12-22-8-10-23(11-9-22)13-17(24)21-18(25)20-14-4-2-1-3-5-14/h6-7,14H,1-5,8-13H2,(H2,20,21,24,25)/p+2