N-[4-(4-bromophenyl)sulfanylphenyl]-1,3,5-trimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1,3,5-trimethyl-pyrazole-4-carboxamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1,3,5-trimethyl-pyrazole-4-carboxamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-1,3,5-trimethyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-1,3,5-trimethylpyrazole-4-carboxamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-1,3,5-trimethyl-pyrazole-4-carboxamide Formula: C19H18BrN3OS MolecularWeight: 416.33472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3OS/c1-12-18(13(2)23(3)22-12)19(24)21-15-6-10-17(11-7-15)25-16-8-4-14(20)5-9-16/h4-11H,1-3H3,(H,21,24)