[1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-3-pyrazolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(1,3-benzothiazol-2-yl)-5-phenylpyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(1,3-benzothiazol-2-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazino)methanone Formula: C22H21N5OS MolecularWeight: 403.50004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N5OS/c1-25-11-13-26(14-12-25)21(28)18-15-19(16-7-3-2-4-8-16)27(24-18)22-23-17-9-5-6-10-20(17)29-22/h2-10,15H,11-14H2,1H3