(2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide

Systemtic Name: (2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide Openeye Name: (2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide CAS Name: (2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide IUPAC Name: (2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide Traditional Name: (2S)-2-phenoxy-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propionamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)OC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c1-16(28-18-10-4-2-5-11-18)21(25)23-17-9-8-12-19(15-17)29(26,27)24-20-13-6-3-7-14-22-20/h2,4-5,8-12,15-16H,3,6-7,13-14H2,1H3,(H,22,24)(H,23,25)/t16-/m0/s1