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

Systemtic Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-N-(4-methylcyclohexyl)butanamide Openeye Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-N-(4-methylcyclohexyl)butanamide CAS Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-N-(4-methylcyclohexyl)butanamide IUPAC Name: (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-N-(4-methylcyclohexyl)butanamide Traditional Name: (2S)-3-methyl-N-(4-methylcyclohexyl)-2-(piazthiol-4-ylsulfonylamino)butyramide Formula: C18H26N4O3S2 MolecularWeight: 410.55404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC1CCC(CC1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H26N4O3S2/c1-11(2)16(18(23)19-13-9-7-12(3)8-10-13)22-27(24,25)15-6-4-5-14-17(15)21-26-20-14/h4-6,11-13,16,22H,7-10H2,1-3H3,(H,19,23)/t12?,13?,16-/m0/s1