N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[methylsulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[methylsulfonyl-(phenylmethyl)amino]benzamide Openeye Name: 2-[benzyl(methylsulfonyl)amino]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[methylsulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: 2-[benzyl(methylsulfonyl)amino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide Traditional Name: 2-[benzyl(mesyl)amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzamide Formula: C26H26N4O4S MolecularWeight: 490.57404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3N(CC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3N(CC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C26H26N4O4S/c1-19-24(26(32)30(28(19)2)21-14-8-5-9-15-21)27-25(31)22-16-10-11-17-23(22)29(35(3,33)34)18-20-12-6-4-7-13-20/h4-17H,18H2,1-3H3,(H,27,31)