5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)-1,2-thiazole-4-carboxylic acid; methanoic acid

Systemtic Name: 5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)-1,2-thiazole-4-carboxylic acid; methanoic acid Openeye Name: 5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)isothiazole-4-carboxylic acid; formic acid CAS Name: 5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)-4-isothiazolecarboxylic acid; formic acid IUPAC Name: 5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)-1,2-thiazole-4-carboxylic acid; formic acid Traditional Name: 5-(1H-benzimidazol-2-ylamino)-3-(cyclohexylmethoxy)isothiazole-4-carboxylic acid; formic acid Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=NSC(=C2C(=O)O)NC3=NC4=CC=CC=C4N3.C(=O)O

Isomeric SMILES

C1CCC(CC1)COC2=NSC(=C2C(=O)O)NC3=NC4=CC=CC=C4N3.C(=O)O

InChI

InChI=1S/C18H20N4O3S.CH2O2/c23-17(24)14-15(25-10-11-6-2-1-3-7-11)22-26-16(14)21-18-19-12-8-4-5-9-13(12)20-18;2-1-3/h4-5,8-9,11H,1-3,6-7,10H2,(H,23,24)(H2,19,20,21);1H,(H,2,3)