2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-1-morpholino-ethanone CAS Name: 2-[[4-(3,5-dimethyl-1-pyrazolyl)-1-phthalazinyl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-1-morpholin-4-ylethanone Traditional Name: 2-[[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]thio]-1-morpholino-ethanone Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C3=CC=CC=C32)SCC(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C3=CC=CC=C32)SCC(=O)N4CCOCC4)C

InChI

InChI=1S/C19H21N5O2S/c1-13-11-14(2)24(22-13)18-15-5-3-4-6-16(15)19(21-20-18)27-12-17(25)23-7-9-26-10-8-23/h3-6,11H,7-10,12H2,1-2H3