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

Systemtic Name: N-[(3-chloranyl-5-ethoxy-4-methoxy-phenyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[(3-chloro-5-ethoxy-4-methoxy-phenyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[(3-chloro-5-ethoxy-4-methoxyphenyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[(3-chloro-5-ethoxy-4-methoxyphenyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: (3-chloro-5-ethoxy-4-methoxy-benzyl)-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C19H22ClN5O2S MolecularWeight: 419.92828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNCCSC2=NN=NN2C3=CC=CC=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNCCSC2=NN=NN2C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C19H22ClN5O2S/c1-3-27-17-12-14(11-16(20)18(17)26-2)13-21-9-10-28-19-22-23-24-25(19)15-7-5-4-6-8-15/h4-8,11-12,21H,3,9-10,13H2,1-2H3