N-[(3-phenylmethoxyphenyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine

Systemtic Name: N-[(3-phenylmethoxyphenyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[(3-benzyloxyphenyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[(3-phenylmethoxyphenyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[(3-phenylmethoxyphenyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: (3-benzoxybenzyl)-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)CNCCSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)CNCCSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C23H23N5OS/c1-3-8-19(9-4-1)18-29-22-13-7-10-20(16-22)17-24-14-15-30-23-25-26-27-28(23)21-11-5-2-6-12-21/h1-13,16,24H,14-15,17-18H2