ethyl 3-[2-(5-pyrrolidin-1-ylcarbonylbenzimidazol-1-yl)ethylcarbamoylamino]propanoate

Systemtic Name: ethyl 3-[2-(5-pyrrolidin-1-ylcarbonylbenzimidazol-1-yl)ethylcarbamoylamino]propanoate Openeye Name: ethyl 3-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]propanoate CAS Name: 3-[[oxo-[2-[5-[oxo(1-pyrrolidinyl)methyl]-1-benzimidazolyl]ethylamino]methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]propanoate Traditional Name: 3-[2-[5-(pyrrolidine-1-carbonyl)benzimidazol-1-yl]ethylcarbamoylamino]propionic acid ethyl ester Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)NCCN1C=NC2=C1C=CC(=C2)C(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)CCNC(=O)NCCN1C=NC2=C1C=CC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H27N5O4/c1-2-29-18(26)7-8-21-20(28)22-9-12-25-14-23-16-13-15(5-6-17(16)25)19(27)24-10-3-4-11-24/h5-6,13-14H,2-4,7-12H2,1H3,(H2,21,22,28)