N-[2-[3-azanyl-5-(2-fluorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: N-[2-[3-azanyl-5-(2-fluorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethyl]pyridine-3-carboxamide Openeye Name: N-[2-[3-amino-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethyl]pyridine-3-carboxamide CAS Name: N-[2-[3-amino-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[3-amino-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethyl]pyridine-3-carboxamide Traditional Name: N-[2-[3-amino-5-(2-fluorophenyl)-2-keto-3H-1,4-benzodiazepin-1-yl]ethyl]nicotinamide Formula: C23H20FN5O2 MolecularWeight: 417.435603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(C(=O)N2CCNC(=O)C3=CN=CC=C3)N)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(C(=O)N2CCNC(=O)C3=CN=CC=C3)N)C4=CC=CC=C4F

InChI

InChI=1S/C23H20FN5O2/c24-18-9-3-1-7-16(18)20-17-8-2-4-10-19(17)29(23(31)21(25)28-20)13-12-27-22(30)15-6-5-11-26-14-15/h1-11,14,21H,12-13,25H2,(H,27,30)