2-[(5,6-dimethyl-2-propan-2-yl-benzimidazol-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(5,6-dimethyl-2-propan-2-yl-benzimidazol-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(2-isopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(5,6-dimethyl-2-propan-2-yl-1-benzimidazolyl)methyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(5,6-dimethyl-2-propan-2-ylbenzimidazol-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(2-isopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]-4-methyl-thiazole-5-carboxylic acid Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C(C)C)CC3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)C(C)C)CC3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C18H21N3O2S/c1-9(2)17-20-13-6-10(3)11(4)7-14(13)21(17)8-15-19-12(5)16(24-15)18(22)23/h6-7,9H,8H2,1-5H3,(H,22,23)