1-(4-butylphenyl)-3-[(7-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(7-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(7-fluoro-3-methyl-benzofuran-2-carbonyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[(7-fluoro-3-methyl-2-benzofuranyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(7-fluoro-3-methyl-1-benzofuran-2-carbonyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(7-fluoro-3-methyl-benzofuran-2-carbonyl)amino]thiourea Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C

InChI

InChI=1S/C21H22FN3O2S/c1-3-4-6-14-9-11-15(12-10-14)23-21(28)25-24-20(26)18-13(2)16-7-5-8-17(22)19(16)27-18/h5,7-12H,3-4,6H2,1-2H3,(H,24,26)(H2,23,25,28)