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

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

Systemtic Name:1-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-4-(thiophen-2-ylmethyl)piperazin-1-ium
Openeye Name:1-[(5-phenyltetrazol-2-yl)methyl]-4-(2-thienylmethyl)piperazin-1-ium
CAS Name:1-[(5-phenyl-2-tetrazolyl)methyl]-4-(thiophen-2-ylmethyl)piperazin-1-ium
IUPAC Name:1-[(5-phenyltetrazol-2-yl)methyl]-4-(thiophen-2-ylmethyl)piperazin-1-ium
Traditional Name:1-[(5-phenyltetrazol-2-yl)methyl]-4-(2-thenyl)piperazin-1-ium
Formula: C17H21N6S+
MolecularWeight: 341.45384
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2N=C(N=N2)C3=CC=CC=C3)CC4=CC=CS4


Isomeric SMILES

C1CN(CC[NH+]1CN2N=C(N=N2)C3=CC=CC=C3)CC4=CC=CS4


InChI

InChI=1S/C17H20N6S/c1-2-5-15(6-3-1)17-18-20-23(19-17)14-22-10-8-21(9-11-22)13-16-7-4-12-24-16/h1-7,12H,8-11,13-14H2/p+1


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