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

Systemtic Name: N-[(2-methoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[(2-methoxy-1-naphthyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[(2-methoxy-1-naphthalenyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[(2-methoxynaphthalen-1-yl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: (2-methoxy-1-naphthyl)methyl-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)CNCCSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)CNCCSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS/c1-27-20-12-11-16-7-5-6-10-18(16)19(20)15-22-13-14-28-21-23-24-25-26(21)17-8-3-2-4-9-17/h2-12,22H,13-15H2,1H3