dimethyl 2-[2-(5-pyrrolidin-1-ylcarbonylbenzimidazol-1-yl)ethylcarbamoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(5-pyrrolidin-1-ylcarbonylbenzimidazol-1-yl)ethylcarbamoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[oxo-[2-[5-[oxo(1-pyrrolidinyl)methyl]-1-benzimidazolyl]ethylamino]methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H27N5O6 MolecularWeight: 493.51178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)NCCN2C=NC3=C2C=CC(=C3)C(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)NCCN2C=NC3=C2C=CC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C25H27N5O6/c1-35-23(32)17-5-7-18(24(33)36-2)19(14-17)28-25(34)26-9-12-30-15-27-20-13-16(6-8-21(20)30)22(31)29-10-3-4-11-29/h5-8,13-15H,3-4,9-12H2,1-2H3,(H2,26,28,34)