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

Systemtic Name: [2-[2-[3-(4-methylpiperazin-1-yl)propylamino]pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[2-[3-(4-methylpiperazin-1-yl)propylamino]-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[2-[3-(4-methyl-1-piperazinyl)propylamino]-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[2-[3-(4-methylpiperazin-1-yl)propylamino]pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[2-[3-(4-methylpiperazino)propylamino]-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C21H27N7O2 MolecularWeight: 409.48478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC2=C(C=CC=N2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

CN1CCN(CC1)CCCNC2=C(C=CC=N2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C21H27N7O2/c1-27-11-13-28(14-12-27)10-4-9-24-19-15(5-3-8-23-19)20-25-16-6-2-7-17(18(16)26-20)30-21(22)29/h2-3,5-8H,4,9-14H2,1H3,(H2,22,29)(H,23,24)(H,25,26)