(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: (2S)-3-methyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: (2S)-N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-(tosylamino)butyramide Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H28N4O3S2/c1-5-6-7-8-16-21-22-19(27-16)20-18(24)17(13(2)3)23-28(25,26)15-11-9-14(4)10-12-15/h9-13,17,23H,5-8H2,1-4H3,(H,20,22,24)/t17-/m0/s1