2-pentyl-4-thiomorpholin-4-ylcarbonyl-phthalazin-1-one

Systemtic Name: 2-pentyl-4-thiomorpholin-4-ylcarbonyl-phthalazin-1-one Openeye Name: 2-pentyl-4-(thiomorpholine-4-carbonyl)phthalazin-1-one CAS Name: 4-[oxo(thiomorpholin-4-yl)methyl]-2-pentyl-1-phthalazinone IUPAC Name: 2-pentyl-4-(thiomorpholine-4-carbonyl)phthalazin-1-one Traditional Name: 2-amyl-4-(thiomorpholine-4-carbonyl)phthalazin-1-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCSCC3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCSCC3

InChI

InChI=1S/C18H23N3O2S/c1-2-3-6-9-21-17(22)15-8-5-4-7-14(15)16(19-21)18(23)20-10-12-24-13-11-20/h4-5,7-8H,2-3,6,9-13H2,1H3