2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-N,N-di(propan-2-yl)ethanamide

Systemtic Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-N,N-di(propan-2-yl)ethanamide Openeye Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-N,N-diisopropyl-acetamide CAS Name: 2-[[4-(3,5-dimethyl-1-pyrazolyl)-1-phthalazinyl]thio]-N,N-di(propan-2-yl)acetamide IUPAC Name: 2-[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]sulfanyl-N,N-di(propan-2-yl)acetamide Traditional Name: 2-[[4-(3,5-dimethylpyrazol-1-yl)phthalazin-1-yl]thio]-N,N-diisopropyl-acetamide Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5OS/c1-13(2)25(14(3)4)19(27)12-28-21-18-10-8-7-9-17(18)20(22-23-21)26-16(6)11-15(5)24-26/h7-11,13-14H,12H2,1-6H3