4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(3-propan-2-yloxypropyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(3-propan-2-yloxypropyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(3-isopropoxypropyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(3-propan-2-yloxypropyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(3-propan-2-yloxypropyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(3-isopropoxypropyl)-1,4-diazepane-1-carboxamide Formula: C18H26ClF3N4O2 MolecularWeight: 422.87285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)N1CCCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CC(C)OCCCNC(=O)N1CCCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C18H26ClF3N4O2/c1-13(2)28-10-3-5-23-17(27)26-7-4-6-25(8-9-26)16-15(19)11-14(12-24-16)18(20,21)22/h11-13H,3-10H2,1-2H3,(H,23,27)