ethyl 4-(quinolin-2-ylsulfanylmethyl)benzoate

Systemtic Name: ethyl 4-(quinolin-2-ylsulfanylmethyl)benzoate Openeye Name: ethyl 4-(2-quinolylsulfanylmethyl)benzoate CAS Name: 4-[(2-quinolinylthio)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(quinolin-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(2-quinolylthio)methyl]benzoic acid ethyl ester Formula: C19H17NO2S MolecularWeight: 323.40878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H17NO2S/c1-2-22-19(21)16-9-7-14(8-10-16)13-23-18-12-11-15-5-3-4-6-17(15)20-18/h3-12H,2,13H2,1H3