7-(2-morpholin-4-ylethylsulfanyl)-2-(1H-pyrazol-5-ylamino)phthalazin-1-one

Systemtic Name: 7-(2-morpholin-4-ylethylsulfanyl)-2-(1H-pyrazol-5-ylamino)phthalazin-1-one Openeye Name: 7-(2-morpholinoethylsulfanyl)-2-(1H-pyrazol-5-ylamino)phthalazin-1-one CAS Name: 7-[2-(4-morpholinyl)ethylthio]-2-(1H-pyrazol-5-ylamino)-1-phthalazinone IUPAC Name: 7-(2-morpholin-4-ylethylsulfanyl)-2-(1H-pyrazol-5-ylamino)phthalazin-1-one Traditional Name: 7-(2-morpholinoethylthio)-2-(1H-pyrazol-5-ylamino)phthalazin-1-one Formula: C17H20N6O2S MolecularWeight: 372.4447

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSC2=CC3=C(C=C2)C=NN(C3=O)NC4=CC=NN4

Isomeric SMILES

C1COCCN1CCSC2=CC3=C(C=C2)C=NN(C3=O)NC4=CC=NN4

InChI

InChI=1S/C17H20N6O2S/c24-17-15-11-14(26-10-7-22-5-8-25-9-6-22)2-1-13(15)12-19-23(17)21-16-3-4-18-20-16/h1-4,11-12H,5-10H2,(H2,18,20,21)