1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-pyrimidin-2-ylsulfanyl-pyrrolidine-2,5-dione

Systemtic Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-pyrimidin-2-ylsulfanyl-pyrrolidine-2,5-dione Openeye Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-pyrimidin-2-ylsulfanyl-pyrrolidine-2,5-dione CAS Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-pyrimidinylthio)pyrrolidine-2,5-dione IUPAC Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-pyrimidin-2-ylsulfanylpyrrolidine-2,5-dione Traditional Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-pyrimidylthio)pyrrolidine-2,5-quinone Formula: C22H16N4O2S2 MolecularWeight: 432.51804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)CC(C4=O)SC5=NC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)CC(C4=O)SC5=NC=CC=N5

InChI

InChI=1S/C22H16N4O2S2/c1-13-3-8-16-17(11-13)29-20(25-16)14-4-6-15(7-5-14)26-19(27)12-18(21(26)28)30-22-23-9-2-10-24-22/h2-11,18H,12H2,1H3