S-[[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-ethyl-carbamoyl]amino] 2-phenylcyclopropane-1-carbothioate

Systemtic Name: S-[[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-ethyl-carbamoyl]amino] 2-phenylcyclopropane-1-carbothioate Openeye Name: S-[[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]-ethyl-carbamoyl]amino] 2-phenylcyclopropanecarbothioate CAS Name: 2-phenyl-1-cyclopropanecarbothioic acid S-[[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-N-ethylanilino]-oxomethyl]amino] ester IUPAC Name: S-[[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-ethylcarbamoyl]amino] 2-phenylcyclopropane-1-carbothioate Traditional Name: 2-phenylcyclopropanecarbothioic acid S-[[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]-ethyl-carbamoyl]amino] ester Formula: C30H29N3O5S MolecularWeight: 543.63336

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)C(=O)NSC(=O)C4CC4C5=CC=CC=C5

Isomeric SMILES

CCN(C1=CC=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)C(=O)NSC(=O)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C30H29N3O5S/c1-4-33(30(35)32-39-29(34)23-16-22(23)19-8-6-5-7-9-19)20-10-12-21(13-11-20)38-26-14-15-31-25-18-28(37-3)27(36-2)17-24(25)26/h5-15,17-18,22-23H,4,16H2,1-3H3,(H,32,35)