ethyl 4-[[5-(2-methylpropanoylamino)-1-propyl-benzimidazol-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(2-methylpropanoylamino)-1-propyl-benzimidazol-2-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(2-methylpropanoylamino)-1-propyl-benzimidazol-2-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-[(2-methyl-1-oxopropyl)amino]-1-propyl-2-benzimidazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(2-methylpropanoylamino)-1-propylbenzimidazol-2-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(isobutyrylamino)-1-propyl-benzimidazol-2-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)C(C)C)N=C1CN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)C(C)C)N=C1CN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H33N5O3/c1-5-9-27-19-8-7-17(23-21(28)16(3)4)14-18(19)24-20(27)15-25-10-12-26(13-11-25)22(29)30-6-2/h7-8,14,16H,5-6,9-13,15H2,1-4H3,(H,23,28)