2-[3-(aminomethyl)phenyl]-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-[3-(aminomethyl)phenyl]-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-[3-(aminomethyl)phenyl]-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-[3-(aminomethyl)phenyl]-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-[3-(aminomethyl)phenyl]-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-[3-(aminomethyl)phenyl]-N-[4-(2-mesylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C25H24N4O3S MolecularWeight: 460.54806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC(=C4)CN

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC(=C4)CN

InChI

InChI=1S/C25H24N4O3S/c1-17-14-23(29(28-17)21-7-5-6-18(15-21)16-26)25(30)27-20-12-10-19(11-13-20)22-8-3-4-9-24(22)33(2,31)32/h3-15H,16,26H2,1-2H3,(H,27,30)