4-bromanyl-1,5-dimethyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1,5-dimethyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-1,5-dimethyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide CAS Name: 4-bromo-1,5-dimethyl-N-[2-(phenylthio)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1,5-dimethyl-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-1,5-dimethyl-N-[2-(phenylthio)phenyl]pyrazole-3-carboxamide Formula: C18H16BrN3OS MolecularWeight: 402.30814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)Br

InChI

InChI=1S/C18H16BrN3OS/c1-12-16(19)17(21-22(12)2)18(23)20-14-10-6-7-11-15(14)24-13-8-4-3-5-9-13/h3-11H,1-2H3,(H,20,23)