1-[4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]phenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]phenyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]phenyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[[(4-methyl-2-pyrimidinyl)thio]methyl]phenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]phenyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[[(4-methylpyrimidin-2-yl)thio]methyl]phenyl]pyrrolidine-2,5-quinone Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=CC=C(C=C2)N3C(=O)CCC3=O

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=CC=C(C=C2)N3C(=O)CCC3=O

InChI

InChI=1S/C16H15N3O2S/c1-11-8-9-17-16(18-11)22-10-12-2-4-13(5-3-12)19-14(20)6-7-15(19)21/h2-5,8-9H,6-7,10H2,1H3