7-methyl-4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-methyl-4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-methyl-4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[(4-phenyl-1-phthalazinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(4-phenylphthalazin-1-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-methyl-4-[[(4-phenylphthalazin-1-yl)thio]methyl]coumarin Formula: C25H18N2O2S MolecularWeight: 410.48762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H18N2O2S/c1-16-11-12-19-18(14-23(28)29-22(19)13-16)15-30-25-21-10-6-5-9-20(21)24(26-27-25)17-7-3-2-4-8-17/h2-14H,15H2,1H3