(2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-methylsulfonyl-butanamide

Systemtic Name: (2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-methylsulfonyl-butanamide Openeye Name: (2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-methylsulfonyl-butanamide CAS Name: (2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-methylsulfonylbutanamide IUPAC Name: (2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-methylsulfonylbutanamide Traditional Name: (2R)-2-acetamido-N-(1,3-benzothiazol-2-yl)-4-mesyl-butyramide Formula: C14H17N3O4S2 MolecularWeight: 355.43248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCS(=O)(=O)C)C(=O)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(=O)N[C@H](CCS(=O)(=O)C)C(=O)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H17N3O4S2/c1-9(18)15-11(7-8-23(2,20)21)13(19)17-14-16-10-5-3-4-6-12(10)22-14/h3-6,11H,7-8H2,1-2H3,(H,15,18)(H,16,17,19)/t11-/m1/s1