N-[7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-phenethyl-benzimidazol-5-yl]methanesulfonamide

Systemtic Name: N-[7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-phenethyl-benzimidazol-5-yl]methanesulfonamide Openeye Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenethyl-benzimidazol-5-yl]methanesulfonamide CAS Name: N-[7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-phenethyl-5-benzimidazolyl]methanesulfonamide IUPAC Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenethylbenzimidazol-5-yl]methanesulfonamide Traditional Name: N-[7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenethyl-benzimidazol-5-yl]methanesulfonamide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)N3CCC4=CC=CC=C4C3)N(C=N2)CCC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)N3CCC4=CC=CC=C4C3)N(C=N2)CCC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O3S/c1-34(32,33)28-22-15-23(26(31)29-14-12-20-9-5-6-10-21(20)17-29)25-24(16-22)27-18-30(25)13-11-19-7-3-2-4-8-19/h2-10,15-16,18,28H,11-14,17H2,1H3