4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidinyl]amino]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C24H27N5OS MolecularWeight: 433.56908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CNC3CCCN(C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CNC3CCCN(C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H27N5OS/c1-17-20(23(30)29(27(17)2)19-10-4-3-5-11-19)15-25-18-9-8-14-28(16-18)24-26-21-12-6-7-13-22(21)31-24/h3-7,10-13,18,25H,8-9,14-16H2,1-2H3