5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-esyl-N-homoveratryl-pyrimidine-4-carboxamide Formula: C17H20ClN3O5S MolecularWeight: 413.8758

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl

InChI

InChI=1S/C17H20ClN3O5S/c1-4-27(23,24)17-20-10-12(18)15(21-17)16(22)19-8-7-11-5-6-13(25-2)14(9-11)26-3/h5-6,9-10H,4,7-8H2,1-3H3,(H,19,22)