6-(azepan-1-ylsulfonyl)-2-phenyl-1H-benzimidazole

Systemtic Name: 6-(azepan-1-ylsulfonyl)-2-phenyl-1H-benzimidazole Openeye Name: 6-(azepan-1-ylsulfonyl)-2-phenyl-1H-benzimidazole CAS Name: 6-(1-azepanylsulfonyl)-2-phenyl-1H-benzimidazole IUPAC Name: 6-(azepan-1-ylsulfonyl)-2-phenyl-1H-benzimidazole Traditional Name: 6-(azepan-1-ylsulfonyl)-2-phenyl-1H-benzimidazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C19H21N3O2S/c23-25(24,22-12-6-1-2-7-13-22)16-10-11-17-18(14-16)21-19(20-17)15-8-4-3-5-9-15/h3-5,8-11,14H,1-2,6-7,12-13H2,(H,20,21)