N-[4-(2-azanylethoxy)-3-(4-chloranyl-2-methyl-pyrazol-3-yl)phenyl]-4-bromanyl-benzamide

Systemtic Name: N-[4-(2-azanylethoxy)-3-(4-chloranyl-2-methyl-pyrazol-3-yl)phenyl]-4-bromanyl-benzamide Openeye Name: N-[4-(2-aminoethoxy)-3-(4-chloro-2-methyl-pyrazol-3-yl)phenyl]-4-bromo-benzamide CAS Name: N-[4-(2-aminoethoxy)-3-(4-chloro-2-methyl-3-pyrazolyl)phenyl]-4-bromobenzamide IUPAC Name: N-[4-(2-aminoethoxy)-3-(4-chloro-2-methylpyrazol-3-yl)phenyl]-4-bromobenzamide Traditional Name: N-[4-(2-aminoethoxy)-3-(4-chloro-2-methyl-pyrazol-3-yl)phenyl]-4-bromo-benzamide Formula: C19H18BrClN4O2 MolecularWeight: 449.72882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Cl)C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)Br)OCCN

Isomeric SMILES

CN1C(=C(C=N1)Cl)C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)Br)OCCN

InChI

InChI=1S/C19H18BrClN4O2/c1-25-18(16(21)11-23-25)15-10-14(6-7-17(15)27-9-8-22)24-19(26)12-2-4-13(20)5-3-12/h2-7,10-11H,8-9,22H2,1H3,(H,24,26)