quinolin-8-ylmethyl 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate

Systemtic Name: quinolin-8-ylmethyl 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Openeye Name: 8-quinolylmethyl 4-[(2-methylthiazol-4-yl)methylsulfanyl]benzoate CAS Name: 4-[(2-methyl-4-thiazolyl)methylthio]benzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Traditional Name: 4-[(2-methylthiazol-4-yl)methylthio]benzoic acid 8-quinolylmethyl ester Formula: C22H18N2O2S2 MolecularWeight: 406.52052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H18N2O2S2/c1-15-24-19(13-27-15)14-28-20-9-7-17(8-10-20)22(25)26-12-18-5-2-4-16-6-3-11-23-21(16)18/h2-11,13H,12,14H2,1H3