2-[(2-cyclopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[(2-cyclopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[(2-cyclopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]thiazole-4-carboxylate CAS Name: 2-[(2-cyclopropyl-5,6-dimethyl-1-benzimidazolyl)methyl]-4-thiazolecarboxylate IUPAC Name: 2-[(2-cyclopropyl-5,6-dimethylbenzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(2-cyclopropyl-5,6-dimethyl-benzimidazol-1-yl)methyl]thiazole-4-carboxylate Formula: C17H16N3O2S- MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C3CC3)CC4=NC(=CS4)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)C3CC3)CC4=NC(=CS4)C(=O)[O-]

InChI

InChI=1S/C17H17N3O2S/c1-9-5-12-14(6-10(9)2)20(16(19-12)11-3-4-11)7-15-18-13(8-23-15)17(21)22/h5-6,8,11H,3-4,7H2,1-2H3,(H,21,22)/p-1