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

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanylmethyl]imidazo[1,2-a]pyridine CAS Name: 2-[[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]methyl]imidazo[1,2-a]pyridine IUPAC Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine Traditional Name: 2-[[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]methyl]imidazo[1,2-a]pyridine Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C19H22N4O2S2/c24-27(25,23-11-4-1-2-5-12-23)17-8-9-19(20-13-17)26-15-16-14-22-10-6-3-7-18(22)21-16/h3,6-10,13-14H,1-2,4-5,11-12,15H2