(2R)-N-aminocarbonyl-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-methyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-methyl-butanamide Openeye Name: (2R)-N-carbamoyl-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-3-methylbutanamide IUPAC Name: (2R)-N-carbamoyl-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-3-methylbutanamide Traditional Name: (2R)-N-carbamoyl-2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-3-methyl-butyramide Formula: C20H19FN4O2S MolecularWeight: 398.453863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)SC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN4O2S/c1-11(2)17(18(26)23-20(22)27)28-19-15-6-4-3-5-14(15)16(24-25-19)12-7-9-13(21)10-8-12/h3-11,17H,1-2H3,(H3,22,23,26,27)/t17-/m1/s1