N-(oxolan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: N-(2-oxolanylmethyl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: 2-[(4-phenylphthalazin-1-yl)thio]-N-(tetrahydrofurfuryl)acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c25-19(22-13-16-9-6-12-26-16)14-27-21-18-11-5-4-10-17(18)20(23-24-21)15-7-2-1-3-8-15/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,22,25)