1-[(3R)-3-methylpiperidin-1-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3R)-3-methylpiperidin-1-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone Openeye Name: 1-[(3R)-3-methyl-1-piperidyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone CAS Name: 1-[(3R)-3-methyl-1-piperidinyl]-2-[(4-phenyl-1-phthalazinyl)thio]ethanone IUPAC Name: 1-[(3R)-3-methylpiperidin-1-yl]-2-(4-phenylphthalazin-1-yl)sulfanylethanone Traditional Name: 1-[(3R)-3-methylpiperidino]-2-[(4-phenylphthalazin-1-yl)thio]ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3OS/c1-16-8-7-13-25(14-16)20(26)15-27-22-19-12-6-5-11-18(19)21(23-24-22)17-9-3-2-4-10-17/h2-6,9-12,16H,7-8,13-15H2,1H3/t16-/m1/s1