4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanoic acid Openeye Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanoic acid CAS Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanoic acid IUPAC Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanoic acid Traditional Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]valeric acid Formula: C14H18N2O4S2 MolecularWeight: 342.43372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C14H18N2O4S2/c1-8(2)6-12(14(17)18)16-22(19,20)10-4-5-11-13(7-10)21-9(3)15-11/h4-5,7-8,12,16H,6H2,1-3H3,(H,17,18)