4-azanyl-7-methyl-1-pyridin-2-ylsulfonyl-azepan-3-ol

Systemtic Name: 4-azanyl-7-methyl-1-pyridin-2-ylsulfonyl-azepan-3-ol Openeye Name: 4-amino-7-methyl-1-(2-pyridylsulfonyl)azepan-3-ol CAS Name: 4-amino-7-methyl-1-(2-pyridinylsulfonyl)-3-azepanol IUPAC Name: 4-amino-7-methyl-1-pyridin-2-ylsulfonylazepan-3-ol Traditional Name: 4-amino-7-methyl-1-(2-pyridylsulfonyl)azepan-3-ol Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(CN1S(=O)(=O)C2=CC=CC=N2)O)N

Isomeric SMILES

CC1CCC(C(CN1S(=O)(=O)C2=CC=CC=N2)O)N

InChI

InChI=1S/C12H19N3O3S/c1-9-5-6-10(13)11(16)8-15(9)19(17,18)12-4-2-3-7-14-12/h2-4,7,9-11,16H,5-6,8,13H2,1H3