5-(2-azanylpyrimidin-4-yl)-2-(3-bromanyl-2-chloranyl-phenyl)-1H-pyrrole-3-carboxamide

Systemtic Name: 5-(2-azanylpyrimidin-4-yl)-2-(3-bromanyl-2-chloranyl-phenyl)-1H-pyrrole-3-carboxamide Openeye Name: 5-(2-aminopyrimidin-4-yl)-2-(3-bromo-2-chloro-phenyl)-1H-pyrrole-3-carboxamide CAS Name: 5-(2-amino-4-pyrimidinyl)-2-(3-bromo-2-chlorophenyl)-1H-pyrrole-3-carboxamide IUPAC Name: 5-(2-aminopyrimidin-4-yl)-2-(3-bromo-2-chlorophenyl)-1H-pyrrole-3-carboxamide Traditional Name: 5-(2-aminopyrimidin-4-yl)-2-(3-bromo-2-chloro-phenyl)-1H-pyrrole-3-carboxamide Formula: C15H11BrClN5O MolecularWeight: 392.63774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Br)Cl)C2=C(C=C(N2)C3=NC(=NC=C3)N)C(=O)N

Isomeric SMILES

C1=CC(=C(C(=C1)Br)Cl)C2=C(C=C(N2)C3=NC(=NC=C3)N)C(=O)N

InChI

InChI=1S/C15H11BrClN5O/c16-9-3-1-2-7(12(9)17)13-8(14(18)23)6-11(21-13)10-4-5-20-15(19)22-10/h1-6,21H,(H2,18,23)(H2,19,20,22)