2-azanyl-6-[1-(3-fluorophenyl)-1-oxidanyl-but-3-ynyl]-N,N-dimethyl-benzimidazole-1-sulfonamide

Systemtic Name: 2-azanyl-6-[1-(3-fluorophenyl)-1-oxidanyl-but-3-ynyl]-N,N-dimethyl-benzimidazole-1-sulfonamide Openeye Name: 2-amino-6-[1-(3-fluorophenyl)-1-hydroxy-but-3-ynyl]-N,N-dimethyl-benzimidazole-1-sulfonamide CAS Name: 2-amino-6-[1-(3-fluorophenyl)-1-hydroxybut-3-ynyl]-N,N-dimethyl-1-benzimidazolesulfonamide IUPAC Name: 2-amino-6-[1-(3-fluorophenyl)-1-hydroxybut-3-ynyl]-N,N-dimethylbenzimidazole-1-sulfonamide Traditional Name: 2-amino-6-[1-(3-fluorophenyl)-1-hydroxy-but-3-ynyl]-N,N-dimethyl-benzimidazole-1-sulfonamide Formula: C19H19FN4O3S MolecularWeight: 402.442563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(CC#C)(C3=CC(=CC=C3)F)O)N=C1N

Isomeric SMILES

CN(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(CC#C)(C3=CC(=CC=C3)F)O)N=C1N

InChI

InChI=1S/C19H19FN4O3S/c1-4-10-19(25,13-6-5-7-15(20)11-13)14-8-9-16-17(12-14)24(18(21)22-16)28(26,27)23(2)3/h1,5-9,11-12,25H,10H2,2-3H3,(H2,21,22)