N-(3-methylbutyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3OS/c1-15(2)12-13-22-19(25)14-26-21-18-11-7-6-10-17(18)20(23-24-21)16-8-4-3-5-9-16/h3-11,15H,12-14H2,1-2H3,(H,22,25)