2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-phenyl-1-phthalazinyl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-phenylphthalazin-1-yl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C23H16N4OS MolecularWeight: 396.46434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=CC(=O)N5C=CC=CC5=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=CC(=O)N5C=CC=CC5=N4

InChI

InChI=1S/C23H16N4OS/c28-21-14-17(24-20-12-6-7-13-27(20)21)15-29-23-19-11-5-4-10-18(19)22(25-26-23)16-8-2-1-3-9-16/h1-14H,15H2