N-(1-cyanocyclohexyl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3)C4(CCCCC4)C#N

Isomeric SMILES

CN(C(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3)C4(CCCCC4)C#N

InChI

InChI=1S/C24H24N4OS/c1-28(24(17-25)14-8-3-9-15-24)21(29)16-30-23-20-13-7-6-12-19(20)22(26-27-23)18-10-4-2-5-11-18/h2,4-7,10-13H,3,8-9,14-16H2,1H3