6-azanyl-2-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[[2-(3,4-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(3,4-dimethoxyphenyl)-4-thiazolyl]methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(3,4-dimethoxyphenyl)thiazol-4-yl]methylthio]-1H-pyrimidin-4-one Formula: C16H16N4O3S2 MolecularWeight: 376.45324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC(=O)C=C(N3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC(=O)C=C(N3)N)OC

InChI

InChI=1S/C16H16N4O3S2/c1-22-11-4-3-9(5-12(11)23-2)15-18-10(7-24-15)8-25-16-19-13(17)6-14(21)20-16/h3-7H,8H2,1-2H3,(H3,17,19,20,21)