1-(4-butylphenyl)-3-(2-fluoranyl-5-methyl-phenyl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(2-fluoranyl-5-methyl-phenyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(2-fluoro-5-methyl-phenyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(2-fluoro-5-methylphenyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(2-fluoro-5-methylphenyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(2-fluoro-5-methyl-phenyl)thiourea Formula: C18H21FN2S MolecularWeight: 316.436143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)C)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)C)F

InChI

InChI=1S/C18H21FN2S/c1-3-4-5-14-7-9-15(10-8-14)20-18(22)21-17-12-13(2)6-11-16(17)19/h6-12H,3-5H2,1-2H3,(H2,20,21,22)