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

Systemtic Name: 6-azanyl-2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C14H15N3O2S/c1-2-9-3-5-10(6-4-9)11(18)8-20-14-16-12(15)7-13(19)17-14/h3-7H,2,8H2,1H3,(H3,15,16,17,19)