[2-[6-[3-(1,4-diazepan-1-yl)propyl-methyl-amino]pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate

Systemtic Name: [2-[6-[3-(1,4-diazepan-1-yl)propyl-methyl-amino]pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[6-[3-(1,4-diazepan-1-yl)propyl-methyl-amino]-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[6-[3-(1,4-diazepan-1-yl)propyl-methylamino]-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[6-[3-(1,4-diazepan-1-yl)propyl-methylamino]pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[6-[3-(1,4-diazepan-1-yl)propyl-methyl-amino]-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C22H29N7O2 MolecularWeight: 423.51136

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCCNCC1)C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

CN(CCCN1CCCNCC1)C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C22H29N7O2/c1-28(11-4-13-29-12-3-9-24-10-14-29)19-8-7-16(15-25-19)21-26-17-5-2-6-18(20(17)27-21)31-22(23)30/h2,5-8,15,24H,3-4,9-14H2,1H3,(H2,23,30)(H,26,27)