(2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methyl-pentanoyl chloride

Systemtic Name: (2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methyl-pentanoyl chloride Openeye Name: (2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methyl-pentanoyl chloride CAS Name: (2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methylpentanoyl chloride IUPAC Name: (2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methylpentanoyl chloride Traditional Name: (2S)-2-[1,3-benzothiazol-2-ylsulfonyl(methyl)amino]-4-methyl-valeryl chloride Formula: C14H17ClN2O3S2 MolecularWeight: 360.87938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)Cl)N(C)S(=O)(=O)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)C[C@@H](C(=O)Cl)N(C)S(=O)(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H17ClN2O3S2/c1-9(2)8-11(13(15)18)17(3)22(19,20)14-16-10-6-4-5-7-12(10)21-14/h4-7,9,11H,8H2,1-3H3/t11-/m0/s1