methyl 6-[3-(4-methylphenyl)-2-(5-methylthiophen-2-yl)benzimidazol-5-yl]oxyhexanoate

Systemtic Name: methyl 6-[3-(4-methylphenyl)-2-(5-methylthiophen-2-yl)benzimidazol-5-yl]oxyhexanoate Openeye Name: methyl 6-[2-(5-methyl-2-thienyl)-3-(p-tolyl)benzimidazol-5-yl]oxyhexanoate CAS Name: 6-[[3-(4-methylphenyl)-2-(5-methyl-2-thiophenyl)-5-benzimidazolyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(4-methylphenyl)-2-(5-methylthiophen-2-yl)benzimidazol-5-yl]oxyhexanoate Traditional Name: 6-[2-(5-methyl-2-thienyl)-3-(p-tolyl)benzimidazol-5-yl]oxyhexanoic acid methyl ester Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)OC)N=C2C4=CC=C(S4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)OC)N=C2C4=CC=C(S4)C

InChI

InChI=1S/C26H28N2O3S/c1-18-8-11-20(12-9-18)28-23-17-21(31-16-6-4-5-7-25(29)30-3)13-14-22(23)27-26(28)24-15-10-19(2)32-24/h8-15,17H,4-7,16H2,1-3H3