4-cyano-N-[(3S)-5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[(3S)-5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]benzamide Openeye Name: 4-cyano-N-[(3S)-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]benzamide CAS Name: 4-cyano-N-[(3S)-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]benzamide IUPAC Name: 4-cyano-N-[(3S)-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]benzamide Traditional Name: 4-cyano-N-[(3S)-5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]benzamide Formula: C24H17FN4O2 MolecularWeight: 412.415783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CC=C(C=C3)C#N)C4=CC=CC=C4F

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@@H](C1=O)NC(=O)C3=CC=C(C=C3)C#N)C4=CC=CC=C4F

InChI

InChI=1S/C24H17FN4O2/c1-29-20-9-5-3-7-18(20)21(17-6-2-4-8-19(17)25)27-22(24(29)31)28-23(30)16-12-10-15(14-26)11-13-16/h2-13,22H,1H3,(H,28,30)/t22-/m1/s1