3-[2-(benzimidazol-1-yl)-4-propan-2-yl-1,3-thiazol-5-yl]propanoic acid

Systemtic Name: 3-[2-(benzimidazol-1-yl)-4-propan-2-yl-1,3-thiazol-5-yl]propanoic acid Openeye Name: 3-[2-(benzimidazol-1-yl)-4-isopropyl-thiazol-5-yl]propanoic acid CAS Name: 3-[2-(1-benzimidazolyl)-4-propan-2-yl-5-thiazolyl]propanoic acid IUPAC Name: 3-[2-(benzimidazol-1-yl)-4-propan-2-yl-1,3-thiazol-5-yl]propanoic acid Traditional Name: 3-[2-(benzimidazol-1-yl)-4-isopropyl-thiazol-5-yl]propionic acid Formula: C16H17N3O2S MolecularWeight: 315.39008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(SC(=N1)N2C=NC3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

CC(C)C1=C(SC(=N1)N2C=NC3=CC=CC=C32)CCC(=O)O

InChI

InChI=1S/C16H17N3O2S/c1-10(2)15-13(7-8-14(20)21)22-16(18-15)19-9-17-11-5-3-4-6-12(11)19/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)