3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-4-carboxamide Formula: C24H17BrN4OS MolecularWeight: 489.38698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C24H17BrN4OS/c1-15-7-12-20-21(13-15)31-24(26-20)27-23(30)19-14-29(18-5-3-2-4-6-18)28-22(19)16-8-10-17(25)11-9-16/h2-14H,1H3,(H,26,27,30)