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

Systemtic Name: 2-azanyl-N-[[4-(5-bromanylpyrimidin-2-yl)sulfanylphenyl]carbamoyl]benzamide Openeye Name: 2-amino-N-[[4-(5-bromopyrimidin-2-yl)sulfanylphenyl]carbamoyl]benzamide CAS Name: 2-amino-N-[[4-[(5-bromo-2-pyrimidinyl)thio]anilino]-oxomethyl]benzamide IUPAC Name: 2-amino-N-[[4-(5-bromopyrimidin-2-yl)sulfanylphenyl]carbamoyl]benzamide Traditional Name: 2-amino-N-[[4-[(5-bromopyrimidin-2-yl)thio]phenyl]carbamoyl]benzamide Formula: C18H14BrN5O2S MolecularWeight: 444.30506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrN5O2S/c19-11-9-21-18(22-10-11)27-13-7-5-12(6-8-13)23-17(26)24-16(25)14-3-1-2-4-15(14)20/h1-10H,20H2,(H2,23,24,25,26)