5-bromanyl-N-(2-ethoxyphenyl)-2-propylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(2-ethoxyphenyl)-2-propylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(2-ethoxyphenyl)-2-propylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(2-ethoxyphenyl)-2-(propylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(2-ethoxyphenyl)-2-propylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-o-phenetyl-2-(propylthio)pyrimidine-4-carboxamide Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)NC2=CC=CC=C2OCC)Br

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)NC2=CC=CC=C2OCC)Br

InChI

InChI=1S/C16H18BrN3O2S/c1-3-9-23-16-18-10-11(17)14(20-16)15(21)19-12-7-5-6-8-13(12)22-4-2/h5-8,10H,3-4,9H2,1-2H3,(H,19,21)