[1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-(1-piperidyl)methanone CAS Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-3-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-(1,3-benzothiazol-2-yl)-5-phenylpyrazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-piperidino-methanone Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20N4OS/c27-21(25-13-7-2-8-14-25)18-15-19(16-9-3-1-4-10-16)26(24-18)22-23-17-11-5-6-12-20(17)28-22/h1,3-6,9-12,15H,2,7-8,13-14H2