2-[(2S)-3-naphthalen-1-yloxy-2-oxidanyl-propyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[(2S)-3-naphthalen-1-yloxy-2-oxidanyl-propyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[(2S)-2-hydroxy-3-(1-naphthyloxy)propyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[(2S)-2-hydroxy-3-(1-naphthalenyloxy)propyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[(2S)-2-hydroxy-3-naphthalen-1-yloxypropyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[(2S)-2-hydroxy-3-(1-naphthoxy)propyl]-4-(2-thienyl)phthalazin-1-one Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCC(CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC[C@H](CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5)O

InChI

InChI=1S/C25H20N2O3S/c28-18(16-30-22-12-5-8-17-7-1-2-9-19(17)22)15-27-25(29)21-11-4-3-10-20(21)24(26-27)23-13-6-14-31-23/h1-14,18,28H,15-16H2/t18-/m0/s1