N-(4-bromophenyl)-4-(pyrimidin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(4-bromophenyl)-4-(pyrimidin-2-ylsulfanylmethyl)benzamide Openeye Name: N-(4-bromophenyl)-4-(pyrimidin-2-ylsulfanylmethyl)benzamide CAS Name: N-(4-bromophenyl)-4-[(2-pyrimidinylthio)methyl]benzamide IUPAC Name: N-(4-bromophenyl)-4-(pyrimidin-2-ylsulfanylmethyl)benzamide Traditional Name: N-(4-bromophenyl)-4-[(2-pyrimidylthio)methyl]benzamide Formula: C18H14BrN3OS MolecularWeight: 400.29226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CN=C(N=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3OS/c19-15-6-8-16(9-7-15)22-17(23)14-4-2-13(3-5-14)12-24-18-20-10-1-11-21-18/h1-11H,12H2,(H,22,23)