2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-8-methyl-imidazo[1,2-a]pyridine

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-8-methyl-imidazo[1,2-a]pyridine Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanylmethyl]-8-methyl-imidazo[1,2-a]pyridine CAS Name: 2-[[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]methyl]-8-methylimidazo[1,2-a]pyridine IUPAC Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-8-methylimidazo[1,2-a]pyridine Traditional Name: 2-[[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]methyl]-8-methyl-imidazo[1,2-a]pyridine Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C20H24N4O2S2/c1-16-7-6-10-23-14-17(22-20(16)23)15-27-19-9-8-18(13-21-19)28(25,26)24-11-4-2-3-5-12-24/h6-10,13-14H,2-5,11-12,15H2,1H3