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

Systemtic Name: ethyl 4-[[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-(1-methyl-2-benzimidazolyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[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=C(C=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3C

Isomeric SMILES

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

InChI

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