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

Systemtic Name: 5-[(3,4-dimethoxyphenyl)methylsulfanyl]-1-(phenylmethyl)-1,2,3,4-tetrazole Openeye Name: 1-benzyl-5-[(3,4-dimethoxyphenyl)methylsulfanyl]tetrazole CAS Name: 5-[(3,4-dimethoxyphenyl)methylthio]-1-(phenylmethyl)tetrazole IUPAC Name: 1-benzyl-5-[(3,4-dimethoxyphenyl)methylsulfanyl]tetrazole Traditional Name: 1-benzyl-5-(veratrylthio)tetrazole Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=NN2CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=NN2CC3=CC=CC=C3)OC

InChI

InChI=1S/C17H18N4O2S/c1-22-15-9-8-14(10-16(15)23-2)12-24-17-18-19-20-21(17)11-13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3