ethyl N-[6-(2-piperazin-1-ylpyrimidin-5-yl)-1H-benzimidazol-2-yl]carbamate

Systemtic Name: ethyl N-[6-(2-piperazin-1-ylpyrimidin-5-yl)-1H-benzimidazol-2-yl]carbamate Openeye Name: ethyl N-[6-(2-piperazin-1-ylpyrimidin-5-yl)-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[2-(1-piperazinyl)-5-pyrimidinyl]-1H-benzimidazol-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-(2-piperazin-1-ylpyrimidin-5-yl)-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-(2-piperazinopyrimidin-5-yl)-1H-benzimidazol-2-yl]carbamic acid ethyl ester Formula: C18H21N7O2 MolecularWeight: 367.40504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(N1)C=C(C=C2)C3=CN=C(N=C3)N4CCNCC4

Isomeric SMILES

CCOC(=O)NC1=NC2=C(N1)C=C(C=C2)C3=CN=C(N=C3)N4CCNCC4

InChI

InChI=1S/C18H21N7O2/c1-2-27-18(26)24-16-22-14-4-3-12(9-15(14)23-16)13-10-20-17(21-11-13)25-7-5-19-6-8-25/h3-4,9-11,19H,2,5-8H2,1H3,(H2,22,23,24,26)