N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[1-[(2-anilino-3-pyridinyl)methyl]-3-pyrrolidinyl]-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[1-[(2-anilinopyridin-3-yl)methyl]pyrrolidin-3-yl]-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]-3,5-bis(trifluoromethyl)benzamide Formula: C25H22F6N4O MolecularWeight: 508.458799

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)CC3=C(N=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)CC3=C(N=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C25H22F6N4O/c26-24(27,28)18-11-17(12-19(13-18)25(29,30)31)23(36)34-21-8-10-35(15-21)14-16-5-4-9-32-22(16)33-20-6-2-1-3-7-20/h1-7,9,11-13,21H,8,10,14-15H2,(H,32,33)(H,34,36)