6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]hexanamide

Systemtic Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]hexanamide Openeye Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]hexanamide CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-[4-(1-imidazolyl)phenyl]ethyl]hexanamide IUPAC Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]hexanamide Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]hexanamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCCCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCCCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C25H30N4O5S/c1-19(20-6-8-21(9-7-20)29-14-13-26-18-29)28-25(30)5-3-2-4-12-27-35(31,32)22-10-11-23-24(17-22)34-16-15-33-23/h6-11,13-14,17-19,27H,2-5,12,15-16H2,1H3,(H,28,30)/t19-/m0/s1