[2-[6-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate

Systemtic Name: [2-[6-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[6-(3-piperazin-1-ylpropylamino)-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[6-[3-(1-piperazinyl)propylamino]-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[6-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[6-(3-piperazinopropylamino)-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C20H25N7O2 MolecularWeight: 395.4582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCNC2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

C1CN(CCN1)CCCNC2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C20H25N7O2/c21-20(28)29-16-4-1-3-15-18(16)26-19(25-15)14-5-6-17(24-13-14)23-7-2-10-27-11-8-22-9-12-27/h1,3-6,13,22H,2,7-12H2,(H2,21,28)(H,23,24)(H,25,26)