pyridin-3-yl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: pyridin-3-yl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)carbonyl]piperazine-1-carboxylate Openeye Name: 3-pyridyl 4-(5,6-dimethyl-1H-benzimidazole-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)-oxomethyl]-1-piperazinecarboxylic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 4-(5,6-dimethyl-1H-benzimidazole-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(5,6-dimethyl-1H-benzimidazole-2-carbonyl)piperazine-1-carboxylic acid 3-pyridyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C(=O)N3CCN(CC3)C(=O)OC4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C(=O)N3CCN(CC3)C(=O)OC4=CN=CC=C4

InChI

InChI=1S/C20H21N5O3/c1-13-10-16-17(11-14(13)2)23-18(22-16)19(26)24-6-8-25(9-7-24)20(27)28-15-4-3-5-21-12-15/h3-5,10-12H,6-9H2,1-2H3,(H,22,23)