2-[2-hydroxyethyl-[4-[(7-methylsulfanylquinolin-4-yl)sulfanylmethyl]phenyl]amino]ethyl ethanoate

Systemtic Name: 2-[2-hydroxyethyl-[4-[(7-methylsulfanylquinolin-4-yl)sulfanylmethyl]phenyl]amino]ethyl ethanoate Openeye Name: 2-[N-(2-hydroxyethyl)-4-[(7-methylsulfanyl-4-quinolyl)sulfanylmethyl]anilino]ethyl acetate CAS Name: acetic acid 2-[N-(2-hydroxyethyl)-4-[[[7-(methylthio)-4-quinolinyl]thio]methyl]anilino]ethyl ester IUPAC Name: 2-[N-(2-hydroxyethyl)-4-[(7-methylsulfanylquinolin-4-yl)sulfanylmethyl]anilino]ethyl acetate Traditional Name: acetic acid 2-[N-(2-hydroxyethyl)-4-[[[7-(methylthio)-4-quinolyl]thio]methyl]anilino]ethyl ester Formula: C23H26N2O3S2 MolecularWeight: 442.59414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(CCO)C1=CC=C(C=C1)CSC2=C3C=CC(=CC3=NC=C2)SC

Isomeric SMILES

CC(=O)OCCN(CCO)C1=CC=C(C=C1)CSC2=C3C=CC(=CC3=NC=C2)SC

InChI

InChI=1S/C23H26N2O3S2/c1-17(27)28-14-12-25(11-13-26)19-5-3-18(4-6-19)16-30-23-9-10-24-22-15-20(29-2)7-8-21(22)23/h3-10,15,26H,11-14,16H2,1-2H3