1-(2,3-dimethylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-(2,3-dimethylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-(2,3-dimethylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]tetrazole CAS Name: 1-(2,3-dimethylphenyl)-5-[(2-nitrophenyl)methylthio]tetrazole IUPAC Name: 1-(2,3-dimethylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]tetrazole Traditional Name: 1-(2,3-dimethylphenyl)-5-[(2-nitrobenzyl)thio]tetrazole Formula: C16H15N5O2S MolecularWeight: 341.3876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NN=N2)SCC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C16H15N5O2S/c1-11-6-5-9-14(12(11)2)20-16(17-18-19-20)24-10-13-7-3-4-8-15(13)21(22)23/h3-9H,10H2,1-2H3