1-(4-butylphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(4-butylphenyl)sulfonyl-4-(2-thienylmethyl)piperazin-4-ium CAS Name: 1-(4-butylphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(4-butylphenyl)sulfonyl-4-(2-thenyl)piperazin-4-ium Formula: C19H27N2O2S2+ MolecularWeight: 379.55988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C19H26N2O2S2/c1-2-3-5-17-7-9-19(10-8-17)25(22,23)21-13-11-20(12-14-21)16-18-6-4-15-24-18/h4,6-10,15H,2-3,5,11-14,16H2,1H3/p+1