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

Systemtic Name: N-[[5-(3-chloranyl-4-methoxy-phenyl)furan-2-yl]methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[[5-(3-chloro-4-methoxy-phenyl)-2-furyl]methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[[5-(3-chloro-4-methoxyphenyl)-2-furanyl]methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: [5-(3-chloro-4-methoxy-phenyl)-2-furyl]methyl-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C21H20ClN5O2S MolecularWeight: 441.9338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(O2)CNCCSC3=NN=NN3C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(O2)CNCCSC3=NN=NN3C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H20ClN5O2S/c1-28-20-9-7-15(13-18(20)22)19-10-8-17(29-19)14-23-11-12-30-21-24-25-26-27(21)16-5-3-2-4-6-16/h2-10,13,23H,11-12,14H2,1H3