2-[2-[(2,5,6-trimethylbenzimidazol-1-yl)methyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(2,5,6-trimethylbenzimidazol-1-yl)methyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(2,5,6-trimethylbenzimidazol-1-yl)methyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(2,5,6-trimethyl-1-benzimidazolyl)methyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(2,5,6-trimethylbenzimidazol-1-yl)methyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(2,5,6-trimethylbenzimidazol-1-yl)methyl]thiazol-4-yl]acetic acid Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C)CC3=NC(=CS3)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)C)CC3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C16H17N3O2S/c1-9-4-13-14(5-10(9)2)19(11(3)17-13)7-15-18-12(8-22-15)6-16(20)21/h4-5,8H,6-7H2,1-3H3,(H,20,21)