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

Systemtic Name: 2-[4-(3-methylpyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[4-(3-methyl-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[4-(3-methyl-2-pyridinyl)butylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(3-methylpyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[4-(3-methyl-2-pyridyl)butylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CCCCNC2=NC=C(C(=O)N2)CC3=CN=C(C=C3)C

Isomeric SMILES

CC1=C(N=CC=C1)CCCCNC2=NC=C(C(=O)N2)CC3=CN=C(C=C3)C

InChI

InChI=1S/C21H25N5O/c1-15-6-5-11-22-19(15)7-3-4-10-23-21-25-14-18(20(27)26-21)12-17-9-8-16(2)24-13-17/h5-6,8-9,11,13-14H,3-4,7,10,12H2,1-2H3,(H2,23,25,26,27)