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

Systemtic Name: 2-[4-(5-methyl-1H-imidazol-4-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[4-(5-methyl-1H-imidazol-4-yl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[4-(5-methyl-1H-imidazol-4-yl)butylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[4-(5-methyl-1H-imidazol-4-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-(5-methyl-1H-imidazol-4-yl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(N=CN1)CCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

InChI

InChI=1S/C18H22N6O/c1-13-16(23-12-22-13)6-2-3-8-20-18-21-11-15(17(25)24-18)9-14-5-4-7-19-10-14/h4-5,7,10-12H,2-3,6,8-9H2,1H3,(H,22,23)(H2,20,21,24,25)