5-chloranyl-2-[1-(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)oxypropyl]-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-[1-(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)oxypropyl]-1,3-benzoxazole Openeye Name: 5-chloro-2-[1-(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)oxypropyl]-1,3-benzoxazole CAS Name: 5-chloro-2-[1-[[6-methyl-2-(methylthio)-4-pyrimidinyl]oxy]propyl]-1,3-benzoxazole IUPAC Name: 5-chloro-2-[1-(6-methyl-2-methylsulfanylpyrimidin-4-yl)oxypropyl]-1,3-benzoxazole Traditional Name: 5-chloro-2-[1-[6-methyl-2-(methylthio)pyrimidin-4-yl]oxypropyl]-1,3-benzoxazole Formula: C16H16ClN3O2S MolecularWeight: 349.83514

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(O1)C=CC(=C2)Cl)OC3=NC(=NC(=C3)C)SC

Isomeric SMILES

CCC(C1=NC2=C(O1)C=CC(=C2)Cl)OC3=NC(=NC(=C3)C)SC

InChI

InChI=1S/C16H16ClN3O2S/c1-4-12(21-14-7-9(2)18-16(20-14)23-3)15-19-11-8-10(17)5-6-13(11)22-15/h5-8,12H,4H2,1-3H3