2-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-(5-acetyl-2-methoxy-benzyl)-4-(2-thienyl)phthalazin-1-one Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

InChI

InChI=1S/C22H18N2O3S/c1-14(25)15-9-10-19(27-2)16(12-15)13-24-22(26)18-7-4-3-6-17(18)21(23-24)20-8-5-11-28-20/h3-12H,13H2,1-2H3