2-[[2-ethyl-4-(oxolan-3-yl)hexyl]amino]-N-(3-fluorophenyl)-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: 2-[[2-ethyl-4-(oxolan-3-yl)hexyl]amino]-N-(3-fluorophenyl)-4,5-dihydroimidazole-1-carbothioamide Openeye Name: 2-[(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)amino]-N-(3-fluorophenyl)-4,5-dihydroimidazole-1-carbothioamide CAS Name: 2-[[2-ethyl-4-(3-oxolanyl)hexyl]amino]-N-(3-fluorophenyl)-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: 2-[[2-ethyl-4-(oxolan-3-yl)hexyl]amino]-N-(3-fluorophenyl)-4,5-dihydroimidazole-1-carbothioamide Traditional Name: 2-[(2-ethyl-4-tetrahydrofuran-3-yl-hexyl)amino]-N-(3-fluorophenyl)-2-imidazoline-1-carbothioamide Formula: C22H33FN4OS MolecularWeight: 420.587023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC)C1CCOC1)CNC2=NCCN2C(=S)NC3=CC(=CC=C3)F

Isomeric SMILES

CCC(CC(CC)C1CCOC1)CNC2=NCCN2C(=S)NC3=CC(=CC=C3)F

InChI

InChI=1S/C22H33FN4OS/c1-3-16(12-17(4-2)18-8-11-28-15-18)14-25-21-24-9-10-27(21)22(29)26-20-7-5-6-19(23)13-20/h5-7,13,16-18H,3-4,8-12,14-15H2,1-2H3,(H,24,25)(H,26,29)