(2S)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Openeye Name: (2S)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide CAS Name: (2S)-N-[anilino(oxo)methyl]-2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]propanamide IUPAC Name: (2S)-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Traditional Name: (2S)-2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-N-(phenylcarbamoyl)propionamide Formula: C24H19FN4O2S MolecularWeight: 446.496663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1=CC=CC=C1)SC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN4O2S/c1-15(22(30)27-24(31)26-18-7-3-2-4-8-18)32-23-20-10-6-5-9-19(20)21(28-29-23)16-11-13-17(25)14-12-16/h2-15H,1H3,(H2,26,27,30,31)/t15-/m0/s1