2-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]acetamide CAS Name: 2-[[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[[2-[(4-phenylphthalazin-1-yl)thio]acetyl]amino]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-14(2)23-18(26)12-22-19(27)13-28-21-17-11-7-6-10-16(17)20(24-25-21)15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3,(H,22,27)(H,23,26)