(2S)-2-azanyl-N-[1-[(3-fluorophenyl)methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: (2S)-2-azanyl-N-[1-[(3-fluorophenyl)methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: (2S)-2-amino-N-[1-[(3-fluorophenyl)methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide CAS Name: (2S)-2-amino-N-[1-[(3-fluorophenyl)methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: (2S)-2-amino-N-[1-[(3-fluorophenyl)methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: (2S)-2-amino-N-[1-(3-fluorobenzyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]propionamide Formula: C25H23FN4O2 MolecularWeight: 430.474123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC4=CC(=CC=C4)F)N

Isomeric SMILES

C[C@@H](C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC4=CC(=CC=C4)F)N

InChI

InChI=1S/C25H23FN4O2/c1-16(27)24(31)29-23-25(32)30(15-17-8-7-11-19(26)14-17)21-13-6-5-12-20(21)22(28-23)18-9-3-2-4-10-18/h2-14,16,23H,15,27H2,1H3,(H,29,31)/t16-,23?/m0/s1