3-(2-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(2-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(2-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(2-ethylphenyl)-1-[(4-fluorophenyl)methyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-(2-ethylphenyl)-1-(4-fluorobenzyl)-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C27H26FN3OS MolecularWeight: 459.578243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C(=CC=C4)C)NC3=O

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C(=CC=C4)C)NC3=O

InChI

InChI=1S/C27H26FN3OS/c1-3-20-8-4-5-10-24(20)29-27(33)31(16-19-11-13-23(28)14-12-19)17-22-15-21-9-6-7-18(2)25(21)30-26(22)32/h4-15H,3,16-17H2,1-2H3,(H,29,33)(H,30,32)