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

Systemtic Name: 2-butyloctyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carboxylate Openeye Name: 2-butyloctyl 2-thiazol-4-ylbenzimidazole-1-carboxylate CAS Name: 2-(4-thiazolyl)-1-benzimidazolecarboxylic acid 2-butyloctyl ester IUPAC Name: 2-butyloctyl 2-(1,3-thiazol-4-yl)benzimidazole-1-carboxylate Traditional Name: 2-thiazol-4-ylbenzimidazole-1-carboxylic acid 2-butyloctyl ester Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)COC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

Isomeric SMILES

CCCCCCC(CCCC)COC(=O)N1C2=CC=CC=C2N=C1C3=CSC=N3

InChI

InChI=1S/C23H31N3O2S/c1-3-5-7-8-12-18(11-6-4-2)15-28-23(27)26-21-14-10-9-13-19(21)25-22(26)20-16-29-17-24-20/h9-10,13-14,16-18H,3-8,11-12,15H2,1-2H3