N-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-4-(methylsulfonylamino)benzamide

Systemtic Name: N-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-4-(methylsulfonylamino)benzamide Openeye Name: N-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-4-(methanesulfonamido)benzamide CAS Name: N-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-4-(methanesulfonamido)benzamide IUPAC Name: N-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-4-(methanesulfonamido)benzamide Traditional Name: N-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-4-(methanesulfonamido)benzamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NCCNCC(COC2=CC=CC=C2C#N)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NCCNCC(COC2=CC=CC=C2C#N)O

InChI

InChI=1S/C20H24N4O5S/c1-30(27,28)24-17-8-6-15(7-9-17)20(26)23-11-10-22-13-18(25)14-29-19-5-3-2-4-16(19)12-21/h2-9,18,22,24-25H,10-11,13-14H2,1H3,(H,23,26)