N-tert-butyl-2-[methyl-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]amino]ethanamide

Systemtic Name: N-tert-butyl-2-[methyl-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]amino]ethanamide Openeye Name: N-tert-butyl-2-[methyl-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]acetamide CAS Name: N-tert-butyl-2-[methyl-[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]amino]acetamide IUPAC Name: N-tert-butyl-2-[methyl-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-tert-butyl-2-[methyl-[2-[(4-phenylphthalazin-1-yl)thio]acetyl]amino]acetamide Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2S/c1-23(2,3)24-19(28)14-27(4)20(29)15-30-22-18-13-9-8-12-17(18)21(25-26-22)16-10-6-5-7-11-16/h5-13H,14-15H2,1-4H3,(H,24,28)