N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-2-(2-naphthylsulfonylamino)butanamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-methyl-2-(2-naphthalenylsulfonylamino)butanamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-2-(2-naphthylsulfonylamino)butyramide Formula: C27H30N4O3S MolecularWeight: 490.6171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C(C(C)C)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C(C(C)C)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H30N4O3S/c1-18(2)26(30-35(33,34)24-15-14-21-10-8-9-11-22(21)16-24)27(32)28-17-25-19(3)29-31(20(25)4)23-12-6-5-7-13-23/h5-16,18,26,30H,17H2,1-4H3,(H,28,32)