2-pyridin-3-yl-5-pyrimidin-2-ylsulfanyl-4-(2,3,4-trimethoxyphenyl)-1,3-oxazole

Systemtic Name: 2-pyridin-3-yl-5-pyrimidin-2-ylsulfanyl-4-(2,3,4-trimethoxyphenyl)-1,3-oxazole Openeye Name: 2-(3-pyridyl)-5-pyrimidin-2-ylsulfanyl-4-(2,3,4-trimethoxyphenyl)oxazole CAS Name: 2-(3-pyridinyl)-5-(2-pyrimidinylthio)-4-(2,3,4-trimethoxyphenyl)oxazole IUPAC Name: 2-pyridin-3-yl-5-pyrimidin-2-ylsulfanyl-4-(2,3,4-trimethoxyphenyl)-1,3-oxazole Traditional Name: 2-(3-pyridyl)-5-(2-pyrimidylthio)-4-(2,3,4-trimethoxyphenyl)oxazole Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=C(OC(=N2)C3=CN=CC=C3)SC4=NC=CC=N4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=C(OC(=N2)C3=CN=CC=C3)SC4=NC=CC=N4)OC)OC

InChI

InChI=1S/C21H18N4O4S/c1-26-15-8-7-14(17(27-2)18(15)28-3)16-20(30-21-23-10-5-11-24-21)29-19(25-16)13-6-4-9-22-12-13/h4-12H,1-3H3