N-[4-(morpholin-4-ylmethyl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(morpholin-4-ylmethyl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[4-(morpholinomethyl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[4-(4-morpholinylmethyl)phenyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[4-(morpholin-4-ylmethyl)phenyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-[4-(morpholinomethyl)phenyl]-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C27H26N4O2S MolecularWeight: 470.58594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=C(C=C2)NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1CC2=CC=C(C=C2)NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2S/c32-25(28-22-12-10-20(11-13-22)18-31-14-16-33-17-15-31)19-34-27-24-9-5-4-8-23(24)26(29-30-27)21-6-2-1-3-7-21/h1-13H,14-19H2,(H,28,32)