N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-1-propan-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-1-propan-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-isopropyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-pyrazole-4-sulfonamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-1-propan-2-yl-4-pyrazolesulfonamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide Traditional Name: 1-isopropyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-pyrazole-4-sulfonamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C20H20N4O2S2/c1-13(2)24-12-18(19(22-24)15-7-5-4-6-8-15)28(25,26)23-20-21-16-10-9-14(3)11-17(16)27-20/h4-13H,1-3H3,(H,21,23)