[4-(3,4-dimethoxyphenyl)-2-methylsulfanyl-pyrimidin-5-yl]-morpholin-4-yl-methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)-2-methylsulfanyl-pyrimidin-5-yl]-morpholin-4-yl-methanone Openeye Name: [4-(3,4-dimethoxyphenyl)-2-methylsulfanyl-pyrimidin-5-yl]-morpholino-methanone CAS Name: [4-(3,4-dimethoxyphenyl)-2-(methylthio)-5-pyrimidinyl]-(4-morpholinyl)methanone IUPAC Name: [4-(3,4-dimethoxyphenyl)-2-methylsulfanylpyrimidin-5-yl]-morpholin-4-ylmethanone Traditional Name: [4-(3,4-dimethoxyphenyl)-2-(methylthio)pyrimidin-5-yl]-morpholino-methanone Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2C(=O)N3CCOCC3)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2C(=O)N3CCOCC3)SC)OC

InChI

InChI=1S/C18H21N3O4S/c1-23-14-5-4-12(10-15(14)24-2)16-13(11-19-18(20-16)26-3)17(22)21-6-8-25-9-7-21/h4-5,10-11H,6-9H2,1-3H3