1-(azepan-1-ylsulfonyl)-4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1-(azepan-1-ylsulfonyl)-4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-(azepan-1-ylsulfonyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-(1-azepanylsulfonyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-(azepan-1-ylsulfonyl)-4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-(azepan-1-ylsulfonyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane Formula: C17H24ClF3N4O2S MolecularWeight: 440.91127

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H24ClF3N4O2S/c18-15-12-14(17(19,20)21)13-22-16(15)23-6-5-9-25(11-10-23)28(26,27)24-7-3-1-2-4-8-24/h12-13H,1-11H2