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

Systemtic Name: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl-[(2-phenylmethoxynaphthalen-1-yl)methyl]azanium Openeye Name: (2-benzyloxy-1-naphthyl)methyl-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]ammonium CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]propyl-[(2-phenylmethoxy-1-naphthalenyl)methyl]ammonium IUPAC Name: 3-(1-methyltetrazol-5-yl)sulfanylpropyl-[(2-phenylmethoxynaphthalen-1-yl)methyl]azanium Traditional Name: (2-benzoxy-1-naphthyl)methyl-[3-[(1-methyltetrazol-5-yl)thio]propyl]ammonium Formula: C23H26N5OS+ MolecularWeight: 420.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5OS/c1-28-23(25-26-27-28)30-15-7-14-24-16-21-20-11-6-5-10-19(20)12-13-22(21)29-17-18-8-3-2-4-9-18/h2-6,8-13,24H,7,14-17H2,1H3/p+1