2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl-[(2-phenylmethoxynaphthalen-1-yl)methyl]azanium

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl-[(2-phenylmethoxynaphthalen-1-yl)methyl]azanium Openeye Name: (2-benzyloxy-1-naphthyl)methyl-[2-(1-methyltetrazol-5-yl)sulfanylethyl]ammonium CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]ethyl-[(2-phenylmethoxy-1-naphthalenyl)methyl]ammonium IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanylethyl-[(2-phenylmethoxynaphthalen-1-yl)methyl]azanium Traditional Name: (2-benzoxy-1-naphthyl)methyl-[2-[(1-methyltetrazol-5-yl)thio]ethyl]ammonium Formula: C22H24N5OS+ MolecularWeight: 406.52386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC[NH2+]CC2=C(C=CC3=CC=CC=C32)OCC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=N1)SCC[NH2+]CC2=C(C=CC3=CC=CC=C32)OCC4=CC=CC=C4

InChI

InChI=1S/C22H23N5OS/c1-27-22(24-25-26-27)29-14-13-23-15-20-19-10-6-5-9-18(19)11-12-21(20)28-16-17-7-3-2-4-8-17/h2-12,23H,13-16H2,1H3/p+1