N-[3,5-dimethyl-4-[2-(propan-2-ylamino)ethoxy]phenyl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[3,5-dimethyl-4-[2-(propan-2-ylamino)ethoxy]phenyl]-2-methylsulfonyl-benzamide Openeye Name: N-[4-[2-(isopropylamino)ethoxy]-3,5-dimethyl-phenyl]-2-methylsulfonyl-benzamide CAS Name: N-[3,5-dimethyl-4-[2-(propan-2-ylamino)ethoxy]phenyl]-2-methylsulfonylbenzamide IUPAC Name: N-[3,5-dimethyl-4-[2-(propan-2-ylamino)ethoxy]phenyl]-2-methylsulfonylbenzamide Traditional Name: N-[4-[2-(isopropylamino)ethoxy]-3,5-dimethyl-phenyl]-2-mesyl-benzamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCNC(C)C)C)NC(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1OCCNC(C)C)C)NC(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C21H28N2O4S/c1-14(2)22-10-11-27-20-15(3)12-17(13-16(20)4)23-21(24)18-8-6-7-9-19(18)28(5,25)26/h6-9,12-14,22H,10-11H2,1-5H3,(H,23,24)