N-[2,6-di(propan-2-yl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-diisopropylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2,6-diisopropylphenyl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C28H29N3OS MolecularWeight: 455.61436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3OS/c1-18(2)21-15-10-16-22(19(3)4)27(21)29-25(32)17-33-28-24-14-9-8-13-23(24)26(30-31-28)20-11-6-5-7-12-20/h5-16,18-19H,17H2,1-4H3,(H,29,32)