N-[3-[1-[2-(4-butan-2-ylphenoxy)ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[1-[2-(4-butan-2-ylphenoxy)ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Openeye Name: N-[3-[1-[2-(4-sec-butylphenoxy)ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide CAS Name: N-[3-[1-[2-(4-butan-2-ylphenoxy)ethyl]-2-benzimidazolyl]propyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[1-[2-(4-butan-2-ylphenoxy)ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Traditional Name: N-[3-[1-[2-(4-sec-butylphenoxy)ethyl]benzimidazol-2-yl]propyl]thiophene-2-carboxamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N=C2CCCNC(=O)C4=CC=CS4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3N=C2CCCNC(=O)C4=CC=CS4

InChI

InChI=1S/C27H31N3O2S/c1-3-20(2)21-12-14-22(15-13-21)32-18-17-30-24-9-5-4-8-23(24)29-26(30)11-6-16-28-27(31)25-10-7-19-33-25/h4-5,7-10,12-15,19-20H,3,6,11,16-18H2,1-2H3,(H,28,31)