8-[[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline

Systemtic Name: 8-[[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline Openeye Name: 8-[[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline CAS Name: 8-[[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline IUPAC Name: 8-[[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline Traditional Name: 8-[[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]sulfonyl]quinoline Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H24N4O2S/c1-17-6-2-9-19(23-17)16-24-12-5-13-25(15-14-24)28(26,27)20-10-3-7-18-8-4-11-22-21(18)20/h2-4,6-11H,5,12-16H2,1H3