1-ethyl-3-[[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-ethyl-3-[[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]carbonylamino]thiourea Openeye Name: 1-ethyl-3-[[2-(3-isobutoxyphenyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-ethyl-3-[[[2-[3-(2-methylpropoxy)phenyl]-4-quinolinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[2-[3-(2-methylpropoxy)phenyl]quinoline-4-carbonyl]amino]thiourea Traditional Name: 1-ethyl-3-[[2-(3-isobutoxyphenyl)quinoline-4-carbonyl]amino]thiourea Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C23H26N4O2S/c1-4-24-23(30)27-26-22(28)19-13-21(25-20-11-6-5-10-18(19)20)16-8-7-9-17(12-16)29-14-15(2)3/h5-13,15H,4,14H2,1-3H3,(H,26,28)(H2,24,27,30)