5-chloranyl-N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C18H20ClN3O3S/c1-4-24-14-6-11-5-10(2)25-15(11)7-12(14)8-20-17(23)16-13(19)9-21-18(22-16)26-3/h6-7,9-10H,4-5,8H2,1-3H3,(H,20,23)