N-[[4-(5-bromanylpyrimidin-2-yl)sulfanylphenyl]carbamothioyl]benzamide

Systemtic Name: N-[[4-(5-bromanylpyrimidin-2-yl)sulfanylphenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(5-bromopyrimidin-2-yl)sulfanylphenyl]carbamothioyl]benzamide CAS Name: N-[[4-[(5-bromo-2-pyrimidinyl)thio]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(5-bromopyrimidin-2-yl)sulfanylphenyl]carbamothioyl]benzamide Traditional Name: N-[[4-[(5-bromopyrimidin-2-yl)thio]phenyl]thiocarbamoyl]benzamide Formula: C18H13BrN4OS2 MolecularWeight: 445.35602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)SC3=NC=C(C=N3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)SC3=NC=C(C=N3)Br

InChI

InChI=1S/C18H13BrN4OS2/c19-13-10-20-18(21-11-13)26-15-8-6-14(7-9-15)22-17(25)23-16(24)12-4-2-1-3-5-12/h1-11H,(H2,22,23,24,25)