1-phenyl-4-[(1R)-1-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]propyl]piperazin-4-ium

Systemtic Name: 1-phenyl-4-[(1R)-1-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]propyl]piperazin-4-ium Openeye Name: 1-phenyl-4-[(1R)-1-[1-(2-thienylmethyl)tetrazol-5-yl]propyl]piperazin-4-ium CAS Name: 1-phenyl-4-[(1R)-1-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]propyl]piperazin-4-ium IUPAC Name: 1-phenyl-4-[(1R)-1-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]propyl]piperazin-4-ium Traditional Name: 1-phenyl-4-[(1R)-1-[1-(2-thenyl)tetrazol-5-yl]propyl]piperazin-4-ium Formula: C19H25N6S+ MolecularWeight: 369.507

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1CC2=CC=CS2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](C1=NN=NN1CC2=CC=CS2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H24N6S/c1-2-18(19-20-21-22-25(19)15-17-9-6-14-26-17)24-12-10-23(11-13-24)16-7-4-3-5-8-16/h3-9,14,18H,2,10-13,15H2,1H3/p+1/t18-/m1/s1