1-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylbenzimidazole

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylbenzimidazole Openeye Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylbenzimidazole CAS Name: 1-[4-(1-azepanylsulfonyl)phenyl]sulfonylbenzimidazole IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylbenzimidazole Traditional Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylbenzimidazole Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3C=NC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C19H21N3O4S2/c23-27(24,21-13-5-1-2-6-14-21)16-9-11-17(12-10-16)28(25,26)22-15-20-18-7-3-4-8-19(18)22/h3-4,7-12,15H,1-2,5-6,13-14H2