(2R)-2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2R)-2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-1-iumyl]-N-cyclopropyl-2-phenylacetamide IUPAC Name: (2R)-2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-2-phenylacetamide Traditional Name: (2R)-2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-2-phenyl-acetamide Formula: C20H25ClN3OS+ MolecularWeight: 390.95

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

C1CC1NC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C20H24ClN3OS/c21-18-9-8-17(26-18)14-23-10-12-24(13-11-23)19(15-4-2-1-3-5-15)20(25)22-16-6-7-16/h1-5,8-9,16,19H,6-7,10-14H2,(H,22,25)/p+1/t19-/m1/s1