[4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone

Systemtic Name: [4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone Openeye Name: [4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone CAS Name: [4-(6-bromo-1,3-benzothiazol-2-yl)-1-piperazinyl]-(5-methyl-1-phenyl-4-pyrazolyl)methanone IUPAC Name: [4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]-(5-methyl-1-phenylpyrazol-4-yl)methanone Traditional Name: [4-(6-bromo-1,3-benzothiazol-2-yl)piperazino]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone Formula: C22H20BrN5OS MolecularWeight: 482.3961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)Br

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)Br

InChI

InChI=1S/C22H20BrN5OS/c1-15-18(14-24-28(15)17-5-3-2-4-6-17)21(29)26-9-11-27(12-10-26)22-25-19-8-7-16(23)13-20(19)30-22/h2-8,13-14H,9-12H2,1H3