2-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoylamino]ethanamide

Systemtic Name: 2-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoylamino]ethanamide Openeye Name: 2-[[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]acetyl]amino]acetamide CAS Name: 2-[[2-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-1-oxoethyl]amino]acetamide IUPAC Name: 2-[[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylacetyl]amino]acetamide Traditional Name: 2-[[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]acetyl]amino]acetamide Formula: C15H22N4O4S2 MolecularWeight: 386.48958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCC(=O)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCC(=O)N

InChI

InChI=1S/C15H22N4O4S2/c16-13(20)10-17-14(21)11-24-15-6-5-12(9-18-15)25(22,23)19-7-3-1-2-4-8-19/h5-6,9H,1-4,7-8,10-11H2,(H2,16,20)(H,17,21)