N-[6-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)pyridin-3-yl]-2-(trifluoromethyl)benzamide

Systemtic Name: N-[6-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)pyridin-3-yl]-2-(trifluoromethyl)benzamide Openeye Name: N-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-(trifluoromethyl)benzamide CAS Name: N-[6-[4-[cyclopropyl(oxo)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]-2-(trifluoromethyl)benzamide IUPAC Name: N-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2-(trifluoromethyl)benzamide Traditional Name: N-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-(trifluoromethyl)benzamide Formula: C22H23F3N4O2 MolecularWeight: 432.43883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H23F3N4O2/c23-22(24,25)18-5-2-1-4-17(18)20(30)27-16-8-9-19(26-14-16)28-10-3-11-29(13-12-28)21(31)15-6-7-15/h1-2,4-5,8-9,14-15H,3,6-7,10-13H2,(H,27,30)