ethyl 3-[[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[[4-(1-methyl-2-benzimidazolyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H25N5O3/c1-3-30-20(28)16-7-6-8-17(15-16)23-22(29)27-13-11-26(12-14-27)21-24-18-9-4-5-10-19(18)25(21)2/h4-10,15H,3,11-14H2,1-2H3,(H,23,29)