[4-(azepan-1-ylsulfonyl)phenyl]-(benzimidazol-1-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)phenyl]-(benzimidazol-1-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)phenyl]-(benzimidazol-1-yl)methanone CAS Name: [4-(1-azepanylsulfonyl)phenyl]-(1-benzimidazolyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)phenyl]-(benzimidazol-1-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-(benzimidazol-1-yl)methanone Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c24-20(23-15-21-18-7-3-4-8-19(18)23)16-9-11-17(12-10-16)27(25,26)22-13-5-1-2-6-14-22/h3-4,7-12,15H,1-2,5-6,13-14H2