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

Systemtic Name: 5-[(4-nitrophenyl)methylsulfanyl]-1-(phenylmethyl)-1,2,3,4-tetrazole Openeye Name: 1-benzyl-5-[(4-nitrophenyl)methylsulfanyl]tetrazole CAS Name: 5-[(4-nitrophenyl)methylthio]-1-(phenylmethyl)tetrazole IUPAC Name: 1-benzyl-5-[(4-nitrophenyl)methylsulfanyl]tetrazole Traditional Name: 1-benzyl-5-[(4-nitrobenzyl)thio]tetrazole Formula: C15H13N5O2S MolecularWeight: 327.36102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O2S/c21-20(22)14-8-6-13(7-9-14)11-23-15-16-17-18-19(15)10-12-4-2-1-3-5-12/h1-9H,10-11H2