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

Systemtic Name: 4-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[1-(2-ethoxyphenyl)-5-tetrazolyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(1-o-phenetyltetrazol-5-yl)thio]methyl]-N-phenyl-benzamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H21N5O2S/c1-2-30-21-11-7-6-10-20(21)28-23(25-26-27-28)31-16-17-12-14-18(15-13-17)22(29)24-19-8-4-3-5-9-19/h3-15H,2,16H2,1H3,(H,24,29)