1-(6,7-dimethoxyquinolin-4-yl)oxy-1-(2,3-dimethylphenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea

Systemtic Name: 1-(6,7-dimethoxyquinolin-4-yl)oxy-1-(2,3-dimethylphenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea Openeye Name: 3-[2-(diisopropylamino)ethyl]-1-[(6,7-dimethoxy-4-quinolyl)oxy]-1-(2,3-dimethylphenyl)thiourea CAS Name: 1-[(6,7-dimethoxy-4-quinolinyl)oxy]-1-(2,3-dimethylphenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea IUPAC Name: 1-(6,7-dimethoxyquinolin-4-yl)oxy-1-(2,3-dimethylphenyl)-3-[2-[di(propan-2-yl)amino]ethyl]thiourea Traditional Name: 3-[2-(diisopropylamino)ethyl]-1-[(6,7-dimethoxy-4-quinolyl)oxy]-1-(2,3-dimethylphenyl)thiourea Formula: C28H38N4O3S MolecularWeight: 510.69132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C(=S)NCCN(C(C)C)C(C)C)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C(=S)NCCN(C(C)C)C(C)C)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)C

InChI

InChI=1S/C28H38N4O3S/c1-18(2)31(19(3)4)15-14-30-28(36)32(24-11-9-10-20(5)21(24)6)35-25-12-13-29-23-17-27(34-8)26(33-7)16-22(23)25/h9-13,16-19H,14-15H2,1-8H3,(H,30,36)