methyl 4-[[3-(1H-benzimidazol-2-yl)propylcarbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-(1H-benzimidazol-2-yl)propylcarbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(1H-benzimidazol-2-yl)propylcarbamoylamino]methyl]benzoate CAS Name: 4-[[[[3-(1H-benzimidazol-2-yl)propylamino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1H-benzimidazol-2-yl)propylcarbamoylamino]methyl]benzoate Traditional Name: 4-[[3-(1H-benzimidazol-2-yl)propylcarbamoylamino]methyl]benzoic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCCCC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCCCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H22N4O3/c1-27-19(25)15-10-8-14(9-11-15)13-22-20(26)21-12-4-7-18-23-16-5-2-3-6-17(16)24-18/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,23,24)(H2,21,22,26)