N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-methylsulfonyl-benzamide Openeye Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-2-methylsulfonyl-benzamide CAS Name: N-[[1-(4-ethoxyphenyl)-5-tetrazolyl]methyl]-2-methylsulfonylbenzamide IUPAC Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-2-methylsulfonylbenzamide Traditional Name: 2-mesyl-N-[(1-p-phenetyltetrazol-5-yl)methyl]benzamide Formula: C18H19N5O4S MolecularWeight: 401.43956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C18H19N5O4S/c1-3-27-14-10-8-13(9-11-14)23-17(20-21-22-23)12-19-18(24)15-6-4-5-7-16(15)28(2,25)26/h4-11H,3,12H2,1-2H3,(H,19,24)