4-[6-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylpyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylpyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylpyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]-3-pyridyl]sulfonyl]morpholine Formula: C20H26N4O5S3 MolecularWeight: 498.63924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H26N4O5S3/c25-31(26,23-9-3-1-2-4-10-23)17-5-7-19(21-15-17)30-20-8-6-18(16-22-20)32(27,28)24-11-13-29-14-12-24/h5-8,15-16H,1-4,9-14H2