2-[4-[(5-chloranyl-3-methyl-pyridin-2-yl)amino]butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[4-[(5-chloranyl-3-methyl-pyridin-2-yl)amino]butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-[(5-chloro-3-methyl-2-pyridyl)amino]butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-[(5-chloro-3-methyl-2-pyridinyl)amino]butylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-[(5-chloro-3-methylpyridin-2-yl)amino]butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-[(5-chloro-3-methyl-2-pyridyl)amino]butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C21H25ClN6O MolecularWeight: 412.9158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCNC3=NC=C(C=C3C)Cl

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCNC3=NC=C(C=C3C)Cl

InChI

InChI=1S/C21H25ClN6O/c1-14-9-18(22)13-26-19(14)23-7-3-4-8-24-21-27-12-17(20(29)28-21)10-16-6-5-15(2)25-11-16/h5-6,9,11-13H,3-4,7-8,10H2,1-2H3,(H,23,26)(H2,24,27,28,29)