1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea Traditional Name: 3-ethyl-1-(4-fluorobenzyl)-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C22H24FN3O3S MolecularWeight: 429.507663

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

Isomeric SMILES

CCNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

InChI

InChI=1S/C22H24FN3O3S/c1-4-24-22(30)26(12-14-5-7-17(23)8-6-14)13-16-9-15-10-19(28-2)20(29-3)11-18(15)25-21(16)27/h5-11H,4,12-13H2,1-3H3,(H,24,30)(H,25,27)