methyl 2-[2-[3-(diethylamino)propylamino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[2-[3-(diethylamino)propylamino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)benzimidazole-5-carboxylate Openeye Name: methyl 1-benzyl-2-[2-[3-(diethylamino)propylamino]-2-oxo-ethyl]benzimidazole-5-carboxylate CAS Name: 2-[2-[3-(diethylamino)propylamino]-2-oxoethyl]-1-(phenylmethyl)-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-2-[2-[3-(diethylamino)propylamino]-2-oxoethyl]benzimidazole-5-carboxylate Traditional Name: 1-benzyl-2-[2-[3-(diethylamino)propylamino]-2-keto-ethyl]benzimidazole-5-carboxylic acid methyl ester Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(=O)OC

Isomeric SMILES

CCN(CC)CCCNC(=O)CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(=O)OC

InChI

InChI=1S/C25H32N4O3/c1-4-28(5-2)15-9-14-26-24(30)17-23-27-21-16-20(25(31)32-3)12-13-22(21)29(23)18-19-10-7-6-8-11-19/h6-8,10-13,16H,4-5,9,14-15,17-18H2,1-3H3,(H,26,30)