naphthalen-1-ylmethyl-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]azanium

Systemtic Name: naphthalen-1-ylmethyl-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]azanium Openeye Name: 1-naphthylmethyl-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]ammonium CAS Name: 1-naphthalenylmethyl-[2-[(1-phenyl-5-tetrazolyl)thio]ethyl]ammonium IUPAC Name: naphthalen-1-ylmethyl-[2-(1-phenyltetrazol-5-yl)sulfanylethyl]azanium Traditional Name: 1-naphthylmethyl-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]ammonium Formula: C20H20N5S+ MolecularWeight: 362.4713

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC[NH2+]CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC[NH2+]CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H19N5S/c1-2-10-18(11-3-1)25-20(22-23-24-25)26-14-13-21-15-17-9-6-8-16-7-4-5-12-19(16)17/h1-12,21H,13-15H2/p+1