N-[4-(2-azanylethoxy)-3-(methylsulfonylamino)phenyl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[4-(2-azanylethoxy)-3-(methylsulfonylamino)phenyl]-2-methylsulfonyl-benzamide Openeye Name: N-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-2-methylsulfonyl-benzamide CAS Name: N-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-2-methylsulfonylbenzamide IUPAC Name: N-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-2-methylsulfonylbenzamide Traditional Name: N-[4-(2-aminoethoxy)-3-(methanesulfonamido)phenyl]-2-mesyl-benzamide Formula: C17H21N3O6S2 MolecularWeight: 427.49514

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)OCCN)NS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)OCCN)NS(=O)(=O)C

InChI

InChI=1S/C17H21N3O6S2/c1-27(22,23)16-6-4-3-5-13(16)17(21)19-12-7-8-15(26-10-9-18)14(11-12)20-28(2,24)25/h3-8,11,20H,9-10,18H2,1-2H3,(H,19,21)