N-chloranyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-methoxy-propanamide

Systemtic Name: N-chloranyl-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-methoxy-propanamide Openeye Name: N-chloro-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]carbamothioyl]-3-methoxy-propanamide CAS Name: N-chloro-N-[[4-[(6,7-dimethoxy-4-quinolinyl)oxy]anilino]-sulfanylidenemethyl]-3-methoxypropanamide IUPAC Name: N-chloro-N-[[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamothioyl]-3-methoxypropanamide Traditional Name: N-chloro-N-[[4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl]thiocarbamoyl]-3-methoxy-propionamide Formula: C22H22ClN3O5S MolecularWeight: 475.94518

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)N(C(=S)NC1=CC=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)Cl

Isomeric SMILES

COCCC(=O)N(C(=S)NC1=CC=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)Cl

InChI

InChI=1S/C22H22ClN3O5S/c1-28-11-9-21(27)26(23)22(32)25-14-4-6-15(7-5-14)31-18-8-10-24-17-13-20(30-3)19(29-2)12-16(17)18/h4-8,10,12-13H,9,11H2,1-3H3,(H,25,32)