4-(5-bromanylpyrimidin-2-yl)oxy-N-butylsulfanyl-3-chloranyl-aniline

Systemtic Name: 4-(5-bromanylpyrimidin-2-yl)oxy-N-butylsulfanyl-3-chloranyl-aniline Openeye Name: 4-(5-bromopyrimidin-2-yl)oxy-N-butylsulfanyl-3-chloro-aniline CAS Name: N-[4-[(5-bromo-2-pyrimidinyl)oxy]-3-chlorophenyl]-1-butanesulfenamide IUPAC Name: 4-(5-bromopyrimidin-2-yl)oxy-N-butylsulfanyl-3-chloroaniline Traditional Name: [4-(5-bromopyrimidin-2-yl)oxy-3-chloro-phenyl]-(butylthio)amine Formula: C14H15BrClN3OS MolecularWeight: 388.7104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSNC1=CC(=C(C=C1)OC2=NC=C(C=N2)Br)Cl

Isomeric SMILES

CCCCSNC1=CC(=C(C=C1)OC2=NC=C(C=N2)Br)Cl

InChI

InChI=1S/C14H15BrClN3OS/c1-2-3-6-21-19-11-4-5-13(12(16)7-11)20-14-17-8-10(15)9-18-14/h4-5,7-9,19H,2-3,6H2,1H3