methyl 2-[[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate CAS Name: 2-[[[4-(1-methyl-2-benzimidazolyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1N3CCN(CC3)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1N3CCN(CC3)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C21H23N5O3/c1-24-18-10-6-5-9-17(18)22-20(24)25-11-13-26(14-12-25)21(28)23-16-8-4-3-7-15(16)19(27)29-2/h3-10H,11-14H2,1-2H3,(H,23,28)