N-(3-fluorophenyl)-4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3-fluorophenyl)-4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-[2-imidazo[2,1-b][1,3]benzothiazolyl(oxo)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-fluorophenyl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide Formula: C22H20FN5O2S MolecularWeight: 437.489903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

InChI

InChI=1S/C22H20FN5O2S/c23-15-5-3-6-16(13-15)24-21(30)27-10-4-9-26(11-12-27)20(29)17-14-28-18-7-1-2-8-19(18)31-22(28)25-17/h1-3,5-8,13-14H,4,9-12H2,(H,24,30)