N-[(2S)-3-methylbutan-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-14(2)15(3)22-19(25)13-26-21-18-12-8-7-11-17(18)20(23-24-21)16-9-5-4-6-10-16/h4-12,14-15H,13H2,1-3H3,(H,22,25)/t15-/m0/s1