N-[2-oxidanylidene-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide

Systemtic Name: N-[2-oxidanylidene-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide Openeye Name: N-[2-oxo-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide CAS Name: N-[2-oxo-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]-2-furancarboxamide IUPAC Name: N-[2-oxo-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide Traditional Name: N-[2-keto-5-[3-(trifluoromethyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-3-yl]-2-furamide Formula: C21H14F3N3O3 MolecularWeight: 413.34937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(C(=O)N2)NC(=O)C3=CC=CO3)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(C(=O)N2)NC(=O)C3=CC=CO3)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O3/c22-21(23,24)13-6-3-5-12(11-13)17-14-7-1-2-8-15(14)25-20(29)18(26-17)27-19(28)16-9-4-10-30-16/h1-11,18H,(H,25,29)(H,27,28)