N2-[1-(2-azanylethyl)piperidin-4-yl]-3-[(6-methylpyridin-2-yl)methyl]benzimidazole-2,5-diamine

Systemtic Name: N2-[1-(2-azanylethyl)piperidin-4-yl]-3-[(6-methylpyridin-2-yl)methyl]benzimidazole-2,5-diamine Openeye Name: N2-[1-(2-aminoethyl)-4-piperidyl]-3-[(6-methyl-2-pyridyl)methyl]benzimidazole-2,5-diamine CAS Name: N2-[1-(2-aminoethyl)-4-piperidinyl]-3-[(6-methyl-2-pyridinyl)methyl]benzimidazole-2,5-diamine IUPAC Name: 2-N-[1-(2-aminoethyl)piperidin-4-yl]-3-[(6-methylpyridin-2-yl)methyl]benzimidazole-2,5-diamine Traditional Name: [1-(2-aminoethyl)-4-piperidyl]-[6-amino-1-[(6-methyl-2-pyridyl)methyl]benzimidazol-2-yl]amine Formula: C21H29N7 MolecularWeight: 379.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2C3=C(C=CC(=C3)N)N=C2NC4CCN(CC4)CCN

Isomeric SMILES

CC1=NC(=CC=C1)CN2C3=C(C=CC(=C3)N)N=C2NC4CCN(CC4)CCN

InChI

InChI=1S/C21H29N7/c1-15-3-2-4-18(24-15)14-28-20-13-16(23)5-6-19(20)26-21(28)25-17-7-10-27(11-8-17)12-9-22/h2-6,13,17H,7-12,14,22-23H2,1H3,(H,25,26)