cycloheptylmethyl 2-azanyl-1-(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)benzimidazole-5-carboxylate

Systemtic Name: cycloheptylmethyl 2-azanyl-1-(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)benzimidazole-5-carboxylate Openeye Name: cycloheptylmethyl 2-amino-1-(4-ethyl-4,5-dihydrothiazol-2-yl)benzimidazole-5-carboxylate CAS Name: 2-amino-1-(4-ethyl-4,5-dihydrothiazol-2-yl)-5-benzimidazolecarboxylic acid cycloheptylmethyl ester IUPAC Name: cycloheptylmethyl 2-amino-1-(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)benzimidazole-5-carboxylate Traditional Name: 2-amino-1-(4-ethyl-2-thiazolin-2-yl)benzimidazole-5-carboxylic acid cycloheptylmethyl ester Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CSC(=N1)N2C3=C(C=C(C=C3)C(=O)OCC4CCCCCC4)N=C2N

Isomeric SMILES

CCC1CSC(=N1)N2C3=C(C=C(C=C3)C(=O)OCC4CCCCCC4)N=C2N

InChI

InChI=1S/C21H28N4O2S/c1-2-16-13-28-21(23-16)25-18-10-9-15(11-17(18)24-20(25)22)19(26)27-12-14-7-5-3-4-6-8-14/h9-11,14,16H,2-8,12-13H2,1H3,(H2,22,24)