methyl 4-[[2-(3-aminophenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-(3-aminophenyl)-1-methyl-benzimidazol-5-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-(3-aminophenyl)-1-methyl-benzimidazole-5-carbonyl]amino]butanoate CAS Name: 4-[[[2-(3-aminophenyl)-1-methyl-5-benzimidazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-aminophenyl)-1-methylbenzimidazole-5-carbonyl]amino]butanoate Traditional Name: 4-[[2-(3-aminophenyl)-1-methyl-benzimidazole-5-carbonyl]amino]butyric acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCCC(=O)OC)N=C1C3=CC(=CC=C3)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCCC(=O)OC)N=C1C3=CC(=CC=C3)N

InChI

InChI=1S/C20H22N4O3/c1-24-17-9-8-14(20(26)22-10-4-7-18(25)27-2)12-16(17)23-19(24)13-5-3-6-15(21)11-13/h3,5-6,8-9,11-12H,4,7,10,21H2,1-2H3,(H,22,26)