2-[(3,4-dichlorophenyl)methylsulfanyl]-5-pentyl-1H-pyrimidine-4,6-dione

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-pentyl-1H-pyrimidine-4,6-dione Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-pentyl-1H-pyrimidine-4,6-dione CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-5-pentyl-1H-pyrimidine-4,6-dione IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-pentyl-1H-pyrimidine-4,6-dione Traditional Name: 5-amyl-2-[(3,4-dichlorobenzyl)thio]-1H-pyrimidine-4,6-quinone Formula: C16H18Cl2N2O2S MolecularWeight: 373.29732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(=O)NC(=NC1=O)SCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCC1C(=O)NC(=NC1=O)SCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O2S/c1-2-3-4-5-11-14(21)19-16(20-15(11)22)23-9-10-6-7-12(17)13(18)8-10/h6-8,11H,2-5,9H2,1H3,(H,19,20,21,22)