N-[3,5-bis(trifluoromethyl)phenyl]-3-piperazin-1-yl-azetidine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-piperazin-1-yl-azetidine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-piperazin-1-yl-azetidine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-piperazinyl)-1-azetidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-piperazin-1-ylazetidine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-piperazino-azetidine-1-carboxamide Formula: C16H18F6N4O MolecularWeight: 396.330739

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2CN(C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C2CN(C2)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H18F6N4O/c17-15(18,19)10-5-11(16(20,21)22)7-12(6-10)24-14(27)26-8-13(9-26)25-3-1-23-2-4-25/h5-7,13,23H,1-4,8-9H2,(H,24,27)