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

Systemtic Name: N-[(2-ethoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[(2-ethoxy-1-naphthyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[(2-ethoxy-1-naphthalenyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[(2-ethoxynaphthalen-1-yl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: (2-ethoxy-1-naphthyl)methyl-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)CNCCSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)CNCCSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H23N5OS/c1-2-28-21-13-12-17-8-6-7-11-19(17)20(21)16-23-14-15-29-22-24-25-26-27(22)18-9-4-3-5-10-18/h3-13,23H,2,14-16H2,1H3