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

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[2-[3,4,5-tris(fluoranyl)phenyl]ethanoylamino]propanamide Openeye Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[[2-(3,4,5-trifluorophenyl)acetyl]amino]propanamide CAS Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[[1-oxo-2-(3,4,5-trifluorophenyl)ethyl]amino]propanamide IUPAC Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[[2-(3,4,5-trifluorophenyl)acetyl]amino]propanamide Traditional Name: N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[[2-(3,4,5-trifluorophenyl)acetyl]amino]propionamide Formula: C27H23F3N4O3 MolecularWeight: 508.49173

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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)C)NC(=O)CC4=CC(=C(C(=C4)F)F)F

Isomeric SMILES

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

InChI

InChI=1S/C27H23F3N4O3/c1-15(31-22(35)14-16-12-19(28)23(30)20(29)13-16)26(36)33-25-27(37)34(2)21-11-7-6-10-18(21)24(32-25)17-8-4-3-5-9-17/h3-13,15,25H,14H2,1-2H3,(H,31,35)(H,33,36)