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

Systemtic Name: 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-p-phenetyl-thiourea Formula: C27H26FN3O2S MolecularWeight: 475.577643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C(C=C4)C)NC3=O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C(C=C4)C)NC3=O

InChI

InChI=1S/C27H26FN3O2S/c1-3-33-24-12-10-23(11-13-24)29-27(34)31(16-19-5-8-22(28)9-6-19)17-21-15-20-7-4-18(2)14-25(20)30-26(21)32/h4-15H,3,16-17H2,1-2H3,(H,29,34)(H,30,32)