N-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[4-(3-bromo-4-methoxyphenyl)-2-thiazolyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C21H17BrN4O2S MolecularWeight: 469.35428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4)Br

InChI

InChI=1S/C21H17BrN4O2S/c1-28-19-8-7-16(11-17(19)22)18-13-29-21(24-18)25-20(27)15-5-3-14(4-6-15)12-26-10-2-9-23-26/h2-11,13H,12H2,1H3,(H,24,25,27)