N-[(4-fluorophenyl)methyl]-2-(2-morpholin-4-ylethylamino)-1-(phenylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(2-morpholin-4-ylethylamino)-1-(phenylmethyl)benzimidazole-5-sulfonamide Openeye Name: 1-benzyl-N-[(4-fluorophenyl)methyl]-2-(2-morpholinoethylamino)benzimidazole-5-sulfonamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[2-(4-morpholinyl)ethylamino]-1-(phenylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 1-benzyl-N-[(4-fluorophenyl)methyl]-2-(2-morpholin-4-ylethylamino)benzimidazole-5-sulfonamide Traditional Name: 1-benzyl-N-(4-fluorobenzyl)-2-(2-morpholinoethylamino)benzimidazole-5-sulfonamide Formula: C27H30FN5O3S MolecularWeight: 523.622203

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)S(=O)(=O)NCC5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1CCNC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)S(=O)(=O)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C27H30FN5O3S/c28-23-8-6-21(7-9-23)19-30-37(34,35)24-10-11-26-25(18-24)31-27(29-12-13-32-14-16-36-17-15-32)33(26)20-22-4-2-1-3-5-22/h1-11,18,30H,12-17,19-20H2,(H,29,31)