methyl 3-[[2-[4-(1-azanylcyclopropyl)phenyl]-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-[4-(1-azanylcyclopropyl)phenyl]-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-[4-(1-aminocyclopropyl)phenyl]-1-methyl-benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-[4-(1-aminocyclopropyl)phenyl]-1-methyl-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(1-aminocyclopropyl)phenyl]-1-methylbenzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-[4-(1-aminocyclopropyl)phenyl]-1-methyl-benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OC)N=C1C3=CC=C(C=C3)C4(CC4)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCC(=O)OC)N=C1C3=CC=C(C=C3)C4(CC4)N

InChI

InChI=1S/C22H24N4O3/c1-26-18-8-5-15(21(28)24-12-9-19(27)29-2)13-17(18)25-20(26)14-3-6-16(7-4-14)22(23)10-11-22/h3-8,13H,9-12,23H2,1-2H3,(H,24,28)