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

Systemtic Name: 1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-[(3-bromo-4-fluoro-phenyl)methyl]-3-(4-butylphenyl)thiourea CAS Name: 1-[(3-bromo-4-fluorophenyl)methyl]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[(3-bromo-4-fluorophenyl)methyl]-3-(4-butylphenyl)thiourea Traditional Name: 1-(3-bromo-4-fluoro-benzyl)-3-(4-butylphenyl)thiourea Formula: C18H20BrFN2S MolecularWeight: 395.332203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrFN2S/c1-2-3-4-13-5-8-15(9-6-13)22-18(23)21-12-14-7-10-17(20)16(19)11-14/h5-11H,2-4,12H2,1H3,(H2,21,22,23)