5,5-bis[2-(2-methylpropylsulfanyl)ethyl]-2-phenyl-1H-pyrimidine-4,6-dione

Systemtic Name: 5,5-bis[2-(2-methylpropylsulfanyl)ethyl]-2-phenyl-1H-pyrimidine-4,6-dione Openeye Name: 5,5-bis(2-isobutylsulfanylethyl)-2-phenyl-1H-pyrimidine-4,6-dione CAS Name: 5,5-bis[2-(2-methylpropylthio)ethyl]-2-phenyl-1H-pyrimidine-4,6-dione IUPAC Name: 5,5-bis[2-(2-methylpropylsulfanyl)ethyl]-2-phenyl-1H-pyrimidine-4,6-dione Traditional Name: 5,5-bis[2-(isobutylthio)ethyl]-2-phenyl-1H-pyrimidine-4,6-quinone Formula: C22H32N2O2S2 MolecularWeight: 420.63168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCCC1(C(=O)NC(=NC1=O)C2=CC=CC=C2)CCSCC(C)C

Isomeric SMILES

CC(C)CSCCC1(C(=O)NC(=NC1=O)C2=CC=CC=C2)CCSCC(C)C

InChI

InChI=1S/C22H32N2O2S2/c1-16(2)14-27-12-10-22(11-13-28-15-17(3)4)20(25)23-19(24-21(22)26)18-8-6-5-7-9-18/h5-9,16-17H,10-15H2,1-4H3,(H,23,24,25,26)