2-(3-phenoxypropylsulfanyl)pyrimidin-4-amine

Systemtic Name: 2-(3-phenoxypropylsulfanyl)pyrimidin-4-amine Openeye Name: 2-(3-phenoxypropylsulfanyl)pyrimidin-4-amine CAS Name: 2-(3-phenoxypropylthio)-4-pyrimidinamine IUPAC Name: 2-(3-phenoxypropylsulfanyl)pyrimidin-4-amine Traditional Name: [2-(3-phenoxypropylthio)pyrimidin-4-yl]amine Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCSC2=NC=CC(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)OCCCSC2=NC=CC(=N2)N

InChI

InChI=1S/C13H15N3OS/c14-12-7-8-15-13(16-12)18-10-4-9-17-11-5-2-1-3-6-11/h1-3,5-8H,4,9-10H2,(H2,14,15,16)