5-bromanyl-N-(2-methoxyphenyl)-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(2-methoxyphenyl)-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide Openeye Name: 2-benzylsulfanyl-5-bromo-N-(2-methoxyphenyl)pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(2-methoxyphenyl)-2-(phenylmethylthio)-4-pyrimidinecarboxamide IUPAC Name: 2-benzylsulfanyl-5-bromo-N-(2-methoxyphenyl)pyrimidine-4-carboxamide Traditional Name: 2-(benzylthio)-5-bromo-N-(2-methoxyphenyl)pyrimidine-4-carboxamide Formula: C19H16BrN3O2S MolecularWeight: 430.31824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=NC(=NC=C2Br)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=NC(=NC=C2Br)SCC3=CC=CC=C3

InChI

InChI=1S/C19H16BrN3O2S/c1-25-16-10-6-5-9-15(16)22-18(24)17-14(20)11-21-19(23-17)26-12-13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H,22,24)