1-(2-ethyl-6-methyl-phenyl)-3-[(7-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(7-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(7-fluoro-3-methyl-benzofuran-2-carbonyl)amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[(7-fluoro-3-methyl-2-benzofuranyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(7-fluoro-3-methyl-1-benzofuran-2-carbonyl)amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(7-fluoro-3-methyl-benzofuran-2-carbonyl)amino]thiourea Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C3=C(O2)C(=CC=C3)F)C)C

InChI

InChI=1S/C20H20FN3O2S/c1-4-13-8-5-7-11(2)16(13)22-20(27)24-23-19(25)17-12(3)14-9-6-10-15(21)18(14)26-17/h5-10H,4H2,1-3H3,(H,23,25)(H2,22,24,27)