2-[[5-(1-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-yl-benzimidazol-1-yl]methyl]-1-ethyl-indole-6-carboximidamide

Systemtic Name: 2-[[5-(1-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-yl-benzimidazol-1-yl]methyl]-1-ethyl-indole-6-carboximidamide Openeye Name: 2-[[5-[(1-ethanimidoyl-4-piperidyl)oxy]-2-isopropyl-benzimidazol-1-yl]methyl]-1-ethyl-indole-6-carboxamidine CAS Name: 1-ethyl-2-[[5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-propan-2-yl-1-benzimidazolyl]methyl]-6-indolecarboximidamide IUPAC Name: 2-[[5-(1-ethanimidoylpiperidin-4-yl)oxy-2-propan-2-ylbenzimidazol-1-yl]methyl]-1-ethylindole-6-carboximidamide Traditional Name: 2-[[5-[(1-acetimidoyl-4-piperidyl)oxy]-2-isopropyl-benzimidazol-1-yl]methyl]-1-ethyl-indole-6-carboxamidine Formula: C29H37N7O MolecularWeight: 499.65038

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CN3C4=C(C=C(C=C4)OC5CCN(CC5)C(=N)C)N=C3C(C)C

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CN3C4=C(C=C(C=C4)OC5CCN(CC5)C(=N)C)N=C3C(C)C

InChI

InChI=1S/C29H37N7O/c1-5-35-22(14-20-6-7-21(28(31)32)15-27(20)35)17-36-26-9-8-24(16-25(26)33-29(36)18(2)3)37-23-10-12-34(13-11-23)19(4)30/h6-9,14-16,18,23,30H,5,10-13,17H2,1-4H3,(H3,31,32)