2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]isoindoline-1,3-quinone Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H15N3O2S/c1-13-11-17(14-7-3-2-4-8-14)22-20(21-13)26-12-23-18(24)15-9-5-6-10-16(15)19(23)25/h2-11H,12H2,1H3