N-[2-methyl-4-(2-phenylbutanoylamino)phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[2-methyl-4-(2-phenylbutanoylamino)phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-methyl-4-(2-phenylbutanoylamino)phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-methyl-4-[(1-oxo-2-phenylbutyl)amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-methyl-4-(2-phenylbutanoylamino)phenyl]-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[2-methyl-4-(2-phenylbutanoylamino)phenyl]benzamide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)C

InChI

InChI=1S/C25H26N2O4S/c1-4-22(18-9-6-5-7-10-18)25(29)26-20-13-14-23(17(2)15-20)27-24(28)19-11-8-12-21(16-19)32(3,30)31/h5-16,22H,4H2,1-3H3,(H,26,29)(H,27,28)