7-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]heptanamide

Systemtic Name: 7-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]heptanamide Openeye Name: 7-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazol-4-yl]heptanamide CAS Name: 7-[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]heptanamide IUPAC Name: 7-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazol-4-yl]heptanamide Traditional Name: 7-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazol-4-yl]enanthamide Formula: C21H25BrN4OS MolecularWeight: 461.4184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)CCCCCCC(=O)N

Isomeric SMILES

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)CCCCCCC(=O)N

InChI

InChI=1S/C21H25BrN4OS/c1-2-19-16(7-5-3-4-6-8-20(23)27)13-24-26(19)21-25-18(14-28-21)15-9-11-17(22)12-10-15/h9-14H,2-8H2,1H3,(H2,23,27)