1-(5-chloranylthiophen-2-yl)sulfonyl-4-[(1R)-1-phenylethyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-4-[(1R)-1-phenylethyl]piperazin-4-ium Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-[(1R)-1-phenylethyl]piperazin-4-ium CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-4-[(1R)-1-phenylethyl]piperazin-4-ium IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-4-[(1R)-1-phenylethyl]piperazin-4-ium Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-[(1R)-1-phenylethyl]piperazin-4-ium Formula: C16H20ClN2O2S2+ MolecularWeight: 371.9252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H19ClN2O2S2/c1-13(14-5-3-2-4-6-14)18-9-11-19(12-10-18)23(20,21)16-8-7-15(17)22-16/h2-8,13H,9-12H2,1H3/p+1/t13-/m1/s1