2-[4-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium Openeye Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium CAS Name: 2-[4-(1-azepanylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium Traditional Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1H-imidazo[1,2-a]pyridin-4-ium Formula: C20H24N3O2S+ MolecularWeight: 370.48846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C20H23N3O2S/c1-16-6-11-20-21-19(15-22(20)14-16)17-7-9-18(10-8-17)26(24,25)23-12-4-2-3-5-13-23/h6-11,14-15H,2-5,12-13H2,1H3/p+1