2-(4-phenylphthalazin-1-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O2S/c1-2-12-21-20(26)22-17(25)13-27-19-16-11-7-6-10-15(16)18(23-24-19)14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H2,21,22,25,26)