3-(2,5-dimethylphenyl)sulfanylpropyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate

Systemtic Name: 3-(2,5-dimethylphenyl)sulfanylpropyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate Openeye Name: 3-(2,5-dimethylphenyl)sulfanylpropyl N-[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamate CAS Name: N-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]phenyl]carbamic acid 3-[(2,5-dimethylphenyl)thio]propyl ester IUPAC Name: 3-(2,5-dimethylphenyl)sulfanylpropyl N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamate Traditional Name: N-[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamic acid 3-[(2,5-dimethylphenyl)thio]propyl ester Formula: C29H30N2O5S MolecularWeight: 518.6239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCCCOC(=O)NC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCCCOC(=O)NC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

InChI

InChI=1S/C29H30N2O5S/c1-19-6-7-20(2)28(16-19)37-15-5-14-35-29(32)31-21-8-10-22(11-9-21)36-25-12-13-30-24-18-27(34-4)26(33-3)17-23(24)25/h6-13,16-18H,5,14-15H2,1-4H3,(H,31,32)