2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(pyrimidin-2-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(pyrimidin-2-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(pyrimidin-2-ylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-(2-pyrimidinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(pyrimidin-2-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-(2-pyrimidylmethyl)-1H-pyrimidin-6-one Formula: C16H19N7OS MolecularWeight: 357.43336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC3=NC=CC=N3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC3=NC=CC=N3

InChI

InChI=1S/C16H19N7OS/c1-11-13(22-10-21-11)9-25-6-5-19-16-20-8-12(15(24)23-16)7-14-17-3-2-4-18-14/h2-4,8,10H,5-7,9H2,1H3,(H,21,22)(H2,19,20,23,24)