N-(4-methylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide

Systemtic Name: N-(4-methylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide Openeye Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-N-(p-tolyl)propanamide CAS Name: N-(4-methylphenyl)-2-[(4-phenyl-1-phthalazinyl)thio]propanamide IUPAC Name: N-(4-methylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanylpropanamide Traditional Name: 2-[(4-phenylphthalazin-1-yl)thio]-N-(p-tolyl)propionamide Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3OS/c1-16-12-14-19(15-13-16)25-23(28)17(2)29-24-21-11-7-6-10-20(21)22(26-27-24)18-8-4-3-5-9-18/h3-15,17H,1-2H3,(H,25,28)