5-bromanyl-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-propylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-propylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-propylsulfanyl-N-[4-(p-tolyl)-1,2,5-oxadiazol-3-yl]pyrimidine-4-carboxamide CAS Name: 5-bromo-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-(propylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-propylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-bromo-2-(propylthio)-N-[4-(p-tolyl)furazan-3-yl]pyrimidine-4-carboxamide Formula: C17H16BrN5O2S MolecularWeight: 434.31024

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)NC2=NON=C2C3=CC=C(C=C3)C)Br

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)NC2=NON=C2C3=CC=C(C=C3)C)Br

InChI

InChI=1S/C17H16BrN5O2S/c1-3-8-26-17-19-9-12(18)14(20-17)16(24)21-15-13(22-25-23-15)11-6-4-10(2)5-7-11/h4-7,9H,3,8H2,1-2H3,(H,21,23,24)