[2-[4-(4-butylpiperazin-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate

Systemtic Name: [2-[4-(4-butylpiperazin-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[4-(4-butylpiperazin-1-yl)-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[4-(4-butyl-1-piperazinyl)-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[4-(4-butylpiperazin-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[4-(4-butylpiperazino)-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=NC=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=NC=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C21H26N6O2/c1-2-3-9-26-10-12-27(13-11-26)17-7-8-23-14-15(17)20-24-16-5-4-6-18(19(16)25-20)29-21(22)28/h4-8,14H,2-3,9-13H2,1H3,(H2,22,28)(H,24,25)