N-aminocarbonyl-3-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide

Systemtic Name: N-aminocarbonyl-3-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide Openeye Name: N-carbamoyl-3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propanamide CAS Name: N-carbamoyl-3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]propanamide IUPAC Name: N-carbamoyl-3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]propanamide Traditional Name: N-carbamoyl-3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]propionamide Formula: C15H19ClF3N5O2 MolecularWeight: 393.79187

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)CCC(=O)NC(=O)N

Isomeric SMILES

C1CN(CCN(C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)CCC(=O)NC(=O)N

InChI

InChI=1S/C15H19ClF3N5O2/c16-11-8-10(15(17,18)19)9-21-13(11)24-4-1-3-23(6-7-24)5-2-12(25)22-14(20)26/h8-9H,1-7H2,(H3,20,22,25,26)