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

Systemtic Name: 1-phenyl-4-[(R)-phenyl-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine-1,4-diium Openeye Name: 1-phenyl-4-[(R)-phenyl-[1-(2-thienylmethyl)tetrazol-5-yl]methyl]piperazine-1,4-diium CAS Name: 1-phenyl-4-[(R)-phenyl-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]piperazine-1,4-diium IUPAC Name: 1-phenyl-4-[(R)-phenyl-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]methyl]piperazine-1,4-diium Traditional Name: 1-phenyl-4-[(R)-phenyl-[1-(2-thenyl)tetrazol-5-yl]methyl]piperazine-1,4-diium Formula: C23H26N6S+2 MolecularWeight: 418.55774

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1C2=CC=CC=C2)C(C3=CC=CC=C3)C4=NN=NN4CC5=CC=CS5

Isomeric SMILES

C1C[NH+](CC[NH+]1C2=CC=CC=C2)[C@H](C3=CC=CC=C3)C4=NN=NN4CC5=CC=CS5

InChI

InChI=1S/C23H24N6S/c1-3-8-19(9-4-1)22(23-24-25-26-29(23)18-21-12-7-17-30-21)28-15-13-27(14-16-28)20-10-5-2-6-11-20/h1-12,17,22H,13-16,18H2/p+2/t22-/m1/s1