N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(2-pyrimidylthio)propionamide Formula: C15H16ClN3O3S MolecularWeight: 353.82384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCSC2=NC=CC=N2)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCSC2=NC=CC=N2)Cl)OC

InChI

InChI=1S/C15H16ClN3O3S/c1-21-12-9-13(22-2)11(8-10(12)16)19-14(20)4-7-23-15-17-5-3-6-18-15/h3,5-6,8-9H,4,7H2,1-2H3,(H,19,20)