methyl 4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[(4-phenylthiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(4-phenyl-2-thiazolyl)thio]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[(4-phenylthiazol-2-yl)thio]methyl]quinoline-3-carboxylic acid methyl ester Formula: C22H18N2O2S2 MolecularWeight: 406.52052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NC(=CS3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NC(=CS3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C22H18N2O2S2/c1-14-16-10-6-7-11-17(16)23-19(20(14)21(25)26-2)13-28-22-24-18(12-27-22)15-8-4-3-5-9-15/h3-12H,13H2,1-2H3