(2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide

Systemtic Name: (2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide Openeye Name: (2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide CAS Name: (2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide IUPAC Name: (2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butanamide Traditional Name: (2R)-2-acetamido-3-methyl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]butyramide Formula: C19H28N4O4S MolecularWeight: 408.51502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NCCCCC2)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O4S/c1-13(2)18(21-14(3)24)19(25)22-15-8-10-16(11-9-15)28(26,27)23-17-7-5-4-6-12-20-17/h8-11,13,18H,4-7,12H2,1-3H3,(H,20,23)(H,21,24)(H,22,25)/t18-/m1/s1