3,7-dimethyloctyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carboxylate

Systemtic Name: 3,7-dimethyloctyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carboxylate Openeye Name: 3,7-dimethyloctyl 2-thiazol-4-ylbenzimidazole-1-carboxylate CAS Name: 2-(4-thiazolyl)-1-benzimidazolecarboxylic acid 3,7-dimethyloctyl ester IUPAC Name: 3,7-dimethyloctyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carboxylate Traditional Name: 2-thiazol-4-ylbenzimidazole-1-carboxylic acid 3,7-dimethyloctyl ester Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCOC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

Isomeric SMILES

CC(C)CCCC(C)CCOC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

InChI

InChI=1S/C21H27N3O2S/c1-15(2)7-6-8-16(3)11-12-26-21(25)24-19-10-5-4-9-17(19)23-20(24)18-13-27-14-22-18/h4-5,9-10,13-16H,6-8,11-12H2,1-3H3