6-azanyl-2-[3-(2-methylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[3-(2-methylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[3-(2-methylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[3-(2-methylphenoxy)propylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[3-(2-methylphenoxy)propylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[3-(2-methylphenoxy)propylthio]-1H-pyrimidin-4-one Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCSC2=NC(=O)C=C(N2)N

Isomeric SMILES

CC1=CC=CC=C1OCCCSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C14H17N3O2S/c1-10-5-2-3-6-11(10)19-7-4-8-20-14-16-12(15)9-13(18)17-14/h2-3,5-6,9H,4,7-8H2,1H3,(H3,15,16,17,18)