3-phenyl-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoic acid

Systemtic Name: 3-phenyl-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoic acid Openeye Name: 2-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]-3-phenyl-propanoic acid CAS Name: 3-phenyl-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoic acid IUPAC Name: 3-phenyl-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoic acid Traditional Name: 2-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]-3-phenyl-propionic acid Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(S2)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(S2)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H20N2O2S/c1-12(2)14-8-9-15-17(11-14)24-19(20-15)21-16(18(22)23)10-13-6-4-3-5-7-13/h3-9,11-12,16H,10H2,1-2H3,(H,20,21)(H,22,23)