6-azanyl-2-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(2,4-dichlorophenyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(2,4-dichlorophenyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(2,4-dichlorophenyl)-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C12H9Cl2N3O2S MolecularWeight: 330.18976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C12H9Cl2N3O2S/c13-6-1-2-7(8(14)3-6)9(18)5-20-12-16-10(15)4-11(19)17-12/h1-4H,5H2,(H3,15,16,17,19)