3-(4-imidazo[1,2-a]pyridin-5-ylsulfanylbutyl)-1-methyl-5-phenyl-6-(phenylmethyl)sulfonyl-pyrimidine-2,4-dione

Systemtic Name: 3-(4-imidazo[1,2-a]pyridin-5-ylsulfanylbutyl)-1-methyl-5-phenyl-6-(phenylmethyl)sulfonyl-pyrimidine-2,4-dione Openeye Name: 6-benzylsulfonyl-3-(4-imidazo[1,2-a]pyridin-5-ylsulfanylbutyl)-1-methyl-5-phenyl-pyrimidine-2,4-dione CAS Name: 3-[4-(5-imidazo[1,2-a]pyridinylthio)butyl]-1-methyl-5-phenyl-6-(phenylmethyl)sulfonylpyrimidine-2,4-dione IUPAC Name: 6-benzylsulfonyl-3-(4-imidazo[1,2-a]pyridin-5-ylsulfanylbutyl)-1-methyl-5-phenylpyrimidine-2,4-dione Traditional Name: 6-benzylsulfonyl-3-[4-(imidazo[1,2-a]pyridin-5-ylthio)butyl]-1-methyl-5-phenyl-pyrimidine-2,4-quinone Formula: C29H28N4O4S2 MolecularWeight: 560.68702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)CCCCSC2=CC=CC3=NC=CN32)C4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)CCCCSC2=CC=CC3=NC=CN32)C4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O4S2/c1-31-28(39(36,37)21-22-11-4-2-5-12-22)26(23-13-6-3-7-14-23)27(34)33(29(31)35)18-8-9-20-38-25-16-10-15-24-30-17-19-32(24)25/h2-7,10-17,19H,8-9,18,20-21H2,1H3