5-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylacetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-[(1-methyl-5-phenyl-2-imidazolyl)thio]-1-oxoethyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C22H19F3N4O2S MolecularWeight: 460.47207

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)N2C(CC(=O)NC3=CC=CC=C32)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CN1C(=CN=C1SCC(=O)N2C(CC(=O)NC3=CC=CC=C32)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H19F3N4O2S/c1-28-17(14-7-3-2-4-8-14)12-26-21(28)32-13-20(31)29-16-10-6-5-9-15(16)27-19(30)11-18(29)22(23,24)25/h2-10,12,18H,11,13H2,1H3,(H,27,30)