N-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]aziridine-1-carboxamide

Systemtic Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]aziridine-1-carboxamide Openeye Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]aziridine-1-carboxamide CAS Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-1-aziridinecarboxamide IUPAC Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]aziridine-1-carboxamide Traditional Name: N-[5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-7-yl]ethylenimine-1-carboxamide Formula: C19H17FN4O2 MolecularWeight: 352.362283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1C=CC(=C2)NC(=O)N3CC3)C4=CC=CC=C4F

Isomeric SMILES

CN1C(=O)CN=C(C2=C1C=CC(=C2)NC(=O)N3CC3)C4=CC=CC=C4F

InChI

InChI=1S/C19H17FN4O2/c1-23-16-7-6-12(22-19(26)24-8-9-24)10-14(16)18(21-11-17(23)25)13-4-2-3-5-15(13)20/h2-7,10H,8-9,11H2,1H3,(H,22,26)