(2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoic acid

Systemtic Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoic acid Openeye Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoic acid CAS Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoic acid IUPAC Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoic acid Traditional Name: (2S)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propionic acid Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C[C@](CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H15NO2S/c1-17(16(19)20,12-7-3-2-4-8-12)11-15-18-13-9-5-6-10-14(13)21-15/h2-10H,11H2,1H3,(H,19,20)/t17-/m0/s1