N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide

Systemtic Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide Openeye Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide CAS Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide IUPAC Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2,1,3-benzoxadiazole-4-sulfonamide Traditional Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]benzofurazan-4-sulfonamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NS(=O)(=O)C2=CC=CC3=NON=C32)C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H](C)NS(=O)(=O)C2=CC=CC3=NON=C32)C

InChI

InChI=1S/C16H17N3O3S/c1-10-7-8-13(11(2)9-10)12(3)19-23(20,21)15-6-4-5-14-16(15)18-22-17-14/h4-9,12,19H,1-3H3/t12-/m0/s1