2-[[7-chloranyl-3-(2-methylsulfanylphenyl)-1,2-benzoxazol-6-yl]oxy]ethanamine

Systemtic Name: 2-[[7-chloranyl-3-(2-methylsulfanylphenyl)-1,2-benzoxazol-6-yl]oxy]ethanamine Openeye Name: 2-[[7-chloro-3-(2-methylsulfanylphenyl)-1,2-benzoxazol-6-yl]oxy]ethanamine CAS Name: 2-[[7-chloro-3-[2-(methylthio)phenyl]-1,2-benzoxazol-6-yl]oxy]ethanamine IUPAC Name: 2-[[7-chloro-3-(2-methylsulfanylphenyl)-1,2-benzoxazol-6-yl]oxy]ethanamine Traditional Name: 2-[7-chloro-3-[2-(methylthio)phenyl]indoxazen-6-yl]oxyethylamine Formula: C16H15ClN2O2S MolecularWeight: 334.8205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2=NOC3=C2C=CC(=C3Cl)OCCN

Isomeric SMILES

CSC1=CC=CC=C1C2=NOC3=C2C=CC(=C3Cl)OCCN

InChI

InChI=1S/C16H15ClN2O2S/c1-22-13-5-3-2-4-10(13)15-11-6-7-12(20-9-8-18)14(17)16(11)21-19-15/h2-7H,8-9,18H2,1H3