N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-1-phenyl-1,2,3,4-tetrazol-5-amine

Systemtic Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-1-phenyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-1-phenyl-tetrazol-5-amine CAS Name: N-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethyl]-1-phenyl-5-tetrazolamine IUPAC Name: N-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethyl]-1-phenyltetrazol-5-amine Traditional Name: [(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-(1-phenyltetrazol-5-yl)amine Formula: C18H24N7S+ MolecularWeight: 370.49506

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CNC2=NN=NN2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CNC2=NN=NN2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C18H23N7S/c1-23-9-11-24(12-10-23)16(17-8-5-13-26-17)14-19-18-20-21-22-25(18)15-6-3-2-4-7-15/h2-8,13,16H,9-12,14H2,1H3,(H,19,20,22)/p+1/t16-/m1/s1