2-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-1,3-benzothiazole

Systemtic Name: 2-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-1,3-benzothiazole Openeye Name: 2-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]-1,3-benzothiazole Traditional Name: 2-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]-1,3-benzothiazole Formula: C18H22N4O2S2 MolecularWeight: 390.52288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC3=CC=CC=C3S2)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1CC2=NC3=CC=CC=C3S2)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C18H22N4O2S2/c1-13-18(26(23,24)21-10-6-3-7-11-21)14(2)22(20-13)12-17-19-15-8-4-5-9-16(15)25-17/h4-5,8-9H,3,6-7,10-12H2,1-2H3