1-[[5-(2-azanylethyl)-1-(3-methylbutyl)benzimidazol-2-yl]methyl]-3-propan-2-yl-benzimidazol-2-one

Systemtic Name: 1-[[5-(2-azanylethyl)-1-(3-methylbutyl)benzimidazol-2-yl]methyl]-3-propan-2-yl-benzimidazol-2-one Openeye Name: 1-[[5-(2-aminoethyl)-1-isopentyl-benzimidazol-2-yl]methyl]-3-isopropyl-benzimidazol-2-one CAS Name: 1-[[5-(2-aminoethyl)-1-(3-methylbutyl)-2-benzimidazolyl]methyl]-3-propan-2-yl-2-benzimidazolone IUPAC Name: 1-[[5-(2-aminoethyl)-1-(3-methylbutyl)benzimidazol-2-yl]methyl]-3-propan-2-ylbenzimidazol-2-one Traditional Name: 1-[[5-(2-aminoethyl)-1-isoamyl-benzimidazol-2-yl]methyl]-3-isopropyl-benzimidazol-2-one Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=C(C=C2)CCN)N=C1CN3C4=CC=CC=C4N(C3=O)C(C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=C(C=C2)CCN)N=C1CN3C4=CC=CC=C4N(C3=O)C(C)C

InChI

InChI=1S/C25H33N5O/c1-17(2)12-14-28-21-10-9-19(11-13-26)15-20(21)27-24(28)16-29-22-7-5-6-8-23(22)30(18(3)4)25(29)31/h5-10,15,17-18H,11-14,16,26H2,1-4H3