(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-cyclopropyl-3-methyl-butanamide

Systemtic Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-cyclopropyl-3-methyl-butanamide Openeye Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-cyclopropyl-3-methyl-butanamide CAS Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-cyclopropyl-3-methylbutanamide IUPAC Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-cyclopropyl-3-methylbutanamide Traditional Name: (2S)-N-cyclopropyl-3-methyl-2-(piazthiol-4-ylsulfonylamino)butyramide Formula: C14H18N4O3S2 MolecularWeight: 354.44772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CC1)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CC1)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C14H18N4O3S2/c1-8(2)12(14(19)15-9-6-7-9)18-23(20,21)11-5-3-4-10-13(11)17-22-16-10/h3-5,8-9,12,18H,6-7H2,1-2H3,(H,15,19)/t12-/m0/s1