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

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N-carbamoyl-2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-carbamoyl-2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazine-1,4-diiumyl]-2-phenylacetamide IUPAC Name: (2R)-N-carbamoyl-2-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-carbamoyl-2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]-2-phenyl-acetamide Formula: C18H23ClN4O2S+2 MolecularWeight: 394.91882

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(S2)Cl)C(C3=CC=CC=C3)C(=O)NC(=O)N

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(S2)Cl)[C@H](C3=CC=CC=C3)C(=O)NC(=O)N

InChI

InChI=1S/C18H21ClN4O2S/c19-15-7-6-14(26-15)12-22-8-10-23(11-9-22)16(17(24)21-18(20)25)13-4-2-1-3-5-13/h1-7,16H,8-12H2,(H3,20,21,24,25)/p+2/t16-/m1/s1