1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-isobutyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)thiourea Traditional Name: 1-(4-fluorobenzyl)-3-isobutyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C23H26FN3O2S MolecularWeight: 427.534843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=C(C=C(C=C3)OC)NC2=O

Isomeric SMILES

CC(C)CNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=C(C=C(C=C3)OC)NC2=O

InChI

InChI=1S/C23H26FN3O2S/c1-15(2)12-25-23(30)27(13-16-4-7-19(24)8-5-16)14-18-10-17-6-9-20(29-3)11-21(17)26-22(18)28/h4-11,15H,12-14H2,1-3H3,(H,25,30)(H,26,28)