2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(2-nitrophenyl)methyl]ethanamine

Systemtic Name: 2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(2-nitrophenyl)methyl]ethanamine Openeye Name: 2-[1-(1-naphthyl)tetrazol-5-yl]sulfanyl-N-[(2-nitrophenyl)methyl]ethanamine CAS Name: 2-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]-N-[(2-nitrophenyl)methyl]ethanamine IUPAC Name: 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-[(2-nitrophenyl)methyl]ethanamine Traditional Name: 2-[[1-(1-naphthyl)tetrazol-5-yl]thio]ethyl-(2-nitrobenzyl)amine Formula: C20H18N6O2S MolecularWeight: 406.46092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCCNCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCCNCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18N6O2S/c27-26(28)18-10-4-2-7-16(18)14-21-12-13-29-20-22-23-24-25(20)19-11-5-8-15-6-1-3-9-17(15)19/h1-11,21H,12-14H2