1-(4-butylphenyl)-3-[(4-chloranyl-2-fluoranyl-phenyl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-chloranyl-2-fluoranyl-phenyl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-chloro-2-fluoro-phenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(4-chloro-2-fluorophenyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-chloro-2-fluorophenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-(4-chloro-2-fluoro-benzyl)thiourea Formula: C18H20ClFN2S MolecularWeight: 350.881203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C18H20ClFN2S/c1-2-3-4-13-5-9-16(10-6-13)22-18(23)21-12-14-7-8-15(19)11-17(14)20/h5-11H,2-4,12H2,1H3,(H2,21,22,23)