1-(2-azanylethyl)-2-(benzimidazol-1-ylmethyl)-6-bromanyl-4,6-dimethyl-5-(piperidin-4-ylamino)pyridin-3-ol

Systemtic Name: 1-(2-azanylethyl)-2-(benzimidazol-1-ylmethyl)-6-bromanyl-4,6-dimethyl-5-(piperidin-4-ylamino)pyridin-3-ol Openeye Name: 1-(2-aminoethyl)-2-(benzimidazol-1-ylmethyl)-6-bromo-4,6-dimethyl-5-(4-piperidylamino)pyridin-3-ol CAS Name: 1-(2-aminoethyl)-2-(1-benzimidazolylmethyl)-6-bromo-4,6-dimethyl-5-(4-piperidinylamino)-3-pyridinol IUPAC Name: 1-(2-aminoethyl)-2-(benzimidazol-1-ylmethyl)-6-bromo-4,6-dimethyl-5-(piperidin-4-ylamino)pyridin-3-ol Traditional Name: 1-(2-aminoethyl)-2-(benzimidazol-1-ylmethyl)-6-bromo-4,6-dimethyl-5-(4-piperidylamino)pyridin-3-ol Formula: C22H31BrN6O MolecularWeight: 475.42514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=C1O)CN2C=NC3=CC=CC=C32)CCN)(C)Br)NC4CCNCC4

Isomeric SMILES

CC1=C(C(N(C(=C1O)CN2C=NC3=CC=CC=C32)CCN)(C)Br)NC4CCNCC4

InChI

InChI=1S/C22H31BrN6O/c1-15-20(30)19(13-28-14-26-17-5-3-4-6-18(17)28)29(12-9-24)22(2,23)21(15)27-16-7-10-25-11-8-16/h3-6,14,16,25,27,30H,7-13,24H2,1-2H3