3-[1-(2-chlorophenyl)ethoxy]-5-[5-(6-piperazin-1-ylpyridin-3-yl)benzimidazol-1-yl]thiophene-2-carboxamide

Systemtic Name: 3-[1-(2-chlorophenyl)ethoxy]-5-[5-(6-piperazin-1-ylpyridin-3-yl)benzimidazol-1-yl]thiophene-2-carboxamide Openeye Name: 3-[1-(2-chlorophenyl)ethoxy]-5-[5-(6-piperazin-1-yl-3-pyridyl)benzimidazol-1-yl]thiophene-2-carboxamide CAS Name: 3-[1-(2-chlorophenyl)ethoxy]-5-[5-[6-(1-piperazinyl)-3-pyridinyl]-1-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: 3-[1-(2-chlorophenyl)ethoxy]-5-[5-(6-piperazin-1-ylpyridin-3-yl)benzimidazol-1-yl]thiophene-2-carboxamide Traditional Name: 3-[1-(2-chlorophenyl)ethoxy]-5-[5-(6-piperazino-3-pyridyl)benzimidazol-1-yl]thiophene-2-carboxamide Formula: C29H27ClN6O2S MolecularWeight: 559.08168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC2=C(SC(=C2)N3C=NC4=C3C=CC(=C4)C5=CN=C(C=C5)N6CCNCC6)C(=O)N

Isomeric SMILES

CC(C1=CC=CC=C1Cl)OC2=C(SC(=C2)N3C=NC4=C3C=CC(=C4)C5=CN=C(C=C5)N6CCNCC6)C(=O)N

InChI

InChI=1S/C29H27ClN6O2S/c1-18(21-4-2-3-5-22(21)30)38-25-15-27(39-28(25)29(31)37)36-17-34-23-14-19(6-8-24(23)36)20-7-9-26(33-16-20)35-12-10-32-11-13-35/h2-9,14-18,32H,10-13H2,1H3,(H2,31,37)