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

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3,4-bis(fluoranyl)phenyl]-2-methyl-propanamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3,4-difluorophenyl)-2-methyl-propanamide CAS Name: N-[1-(2-amino-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3,4-difluorophenyl)-2-methylpropanamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3,4-difluorophenyl)-2-methylpropanamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3,4-difluorophenyl)-2-methyl-propionamide Formula: C27H24F2N4O3 MolecularWeight: 490.501266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)F)F)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)N

Isomeric SMILES

CC(CC1=CC(=C(C=C1)F)F)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C27H24F2N4O3/c1-16(13-17-11-12-20(28)21(29)14-17)26(35)32-25-27(36)33(15-23(30)34)22-10-6-5-9-19(22)24(31-25)18-7-3-2-4-8-18/h2-12,14,16,25H,13,15H2,1H3,(H2,30,34)(H,32,35)