1-pyrimidin-2-yl-3-(3-pyrimidin-2-ylsulfanylpropyl)urea

Systemtic Name: 1-pyrimidin-2-yl-3-(3-pyrimidin-2-ylsulfanylpropyl)urea Openeye Name: 1-pyrimidin-2-yl-3-(3-pyrimidin-2-ylsulfanylpropyl)urea CAS Name: 1-(2-pyrimidinyl)-3-[3-(2-pyrimidinylthio)propyl]urea IUPAC Name: 1-pyrimidin-2-yl-3-(3-pyrimidin-2-ylsulfanylpropyl)urea Traditional Name: 1-(2-pyrimidyl)-3-[3-(2-pyrimidylthio)propyl]urea Formula: C12H14N6OS MolecularWeight: 290.34416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)NCCCSC2=NC=CC=N2

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)NCCCSC2=NC=CC=N2

InChI

InChI=1S/C12H14N6OS/c19-11(18-10-13-4-1-5-14-10)15-8-3-9-20-12-16-6-2-7-17-12/h1-2,4-7H,3,8-9H2,(H2,13,14,15,18,19)