1-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-thiophen-2-yl-methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(R)-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-thiophen-2-yl-methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(R)-(1-tert-butyltetrazol-5-yl)-(2-thienyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(R)-(1-tert-butyl-5-tetrazolyl)-thiophen-2-ylmethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(R)-(1-tert-butyltetrazol-5-yl)-thiophen-2-ylmethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[(R)-(1-tert-butyltetrazol-5-yl)-(2-thienyl)methyl]-4-methyl-piperazine-1,4-diium Formula: C15H26N6S+2 MolecularWeight: 322.47214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C(C2=CC=CS2)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)[C@H](C2=CC=CS2)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C15H24N6S/c1-15(2,3)21-14(16-17-18-21)13(12-6-5-11-22-12)20-9-7-19(4)8-10-20/h5-6,11,13H,7-10H2,1-4H3/p+2/t13-/m0/s1