N-[(1R)-1-cyclopropylethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C21H21N3OS MolecularWeight: 363.47594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C1CC1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3OS/c1-14(15-11-12-15)22-19(25)13-26-21-18-10-6-5-9-17(18)20(23-24-21)16-7-3-2-4-8-16/h2-10,14-15H,11-13H2,1H3,(H,22,25)/t14-/m1/s1